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Structure

N-(3-Methylpyridin-4-yl)ethane-1,2-diamine

CAS
915922-09-7
Catalog Number
ACM915922097
Category
Other Products
Molecular Weight
151.208920 [g/mol]
Molecular Formula
C8H13N3

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Specification

Synonyms
915922-09-7, Ambcb4014008, SureCN3729941, CTK5H0015, MolPort-003-178-999, AKOS013153641, AG-H-76038, AK107400, N1-(3-Methylpyridin-4-yl)ethane-1,2-diamine, N-(3-METHYLPYRIDIN-4-YL)ETHANE-1,2-DIAMINE
IUPAC Name
N-(3-methylpyridin-4-yl)ethane-1,2-diamine
Canonical SMILES
CC1=C(C=CN=C1)NCCN
InChI Key
OKUXSALAQVZSJX-UHFFFAOYSA-N
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of N-(3-Methylpyridin-4-yl)ethane-1,2-diamine?

The molecular formula is C8H13N3.

When was N-(3-Methylpyridin-4-yl)ethane-1,2-diamine created and last modified according to PubChem?

It was created on May 28, 2009, and last modified on December 30, 2023.

What is the IUPAC Name of N-(3-Methylpyridin-4-yl)ethane-1,2-diamine?

The IUPAC Name is N'-(3-methylpyridin-4-yl)ethane-1,2-diamine.

What is the InChIKey of N-(3-Methylpyridin-4-yl)ethane-1,2-diamine?

The InChIKey is OKUXSALAQVZSJX-UHFFFAOYSA-N.

What is the Canonical SMILES of N-(3-Methylpyridin-4-yl)ethane-1,2-diamine?

The Canonical SMILES is CC1=C(C=CN=C1)NCCN.

What is the molecular weight of N-(3-Methylpyridin-4-yl)ethane-1,2-diamine?

The molecular weight is 151.21 g/mol.

How many hydrogen bond donor counts does N-(3-Methylpyridin-4-yl)ethane-1,2-diamine have?

It has 2 hydrogen bond donor counts.

What is the topological polar surface area of N-(3-Methylpyridin-4-yl)ethane-1,2-diamine?

The topological polar surface area is 50.9 Å2.

How many rotatable bond counts does N-(3-Methylpyridin-4-yl)ethane-1,2-diamine have?

It has 3 rotatable bond counts.

Is N-(3-Methylpyridin-4-yl)ethane-1,2-diamine considered as a canonicalized compound according to PubChem?

Yes, it is considered as a canonicalized compound.

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