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1-(1-Thien-2-ylethyl)-1H-pyrazol-5-amine

CAS
956949-76-1
Catalog Number
ACM956949761
Category
Other Products
Molecular Weight
193.268740 [g/mol]
Molecular Formula
C9H11N3S

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Specification

Synonyms
1-(1-thien-2-ylethyl)-1H-pyrazol-5-amine, 2-(1-Thiophen-2-yl-ethyl)-2H-pyrazol-3-ylamine, SBB010895, 1-(2-thienylethyl)pyrazole-5-ylamine, 956949-76-1, AC1MKAGK, AC1Q2BFL, CTK7E0253, MolPort-002-005-313, AKOS000263302, AKOS016346803, RTR-043910, BAS 06502041, 2-(1-thiophen-2-ylethyl)pyrazol-3-amine, TR-043910, 2-[1-(thiophen-2-yl)ethyl]pyrazol-3-amine, ST50280244, EN300-12681, T5342203
IUPAC Name
2-(1-thiophen-2-ylethyl)pyrazol-3-amine
Canonical SMILES
CC(C1=CC=CS1)N2C(=CC=N2)N
InChI Key
CPVPMUSLZDTBPE-UHFFFAOYSA-N
Exact Mass
193.06700
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 1-(1-Thien-2-ylethyl)-1H-pyrazol-5-amine?

The molecular formula is C9H11N3S.

When was this compound created and modified according to PubChem?

It was created on 2005-08-09 and last modified on 2023-12-30.

What is the IUPAC Name of this compound?

The IUPAC Name is 2-(1-thiophen-2-ylethyl)pyrazol-3-amine.

What is the Canonical SMILES of this compound?

The Canonical SMILES is CC(C1=CC=CS1)N2C(=CC=N2)N.

What is the InChIKey of this compound?

The InChIKey is CPVPMUSLZDTBPE-UHFFFAOYSA-N.

What is the molecular weight of 1-(1-Thien-2-ylethyl)-1H-pyrazol-5-amine?

The molecular weight is 193.27 g/mol.

How many hydrogen bond donor counts are there in this compound?

There is 1 hydrogen bond donor count.

What is the XLogP3-AA value of this compound?

The XLogP3-AA value is 1.6.

What is the topological polar surface area of this compound?

The topological polar surface area is 72.1Ų.

Is the compound considered canonicalized according to PubChem?

Yes, the compound is canonicalized.

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