CAS
91089-68-8 Purity
96%
91089-68-8 Purity
96%
Inquiry Basket
5-Nitro-n-(4-(2-(pyrrolidin-1-yl)ethoxy)phenyl)pyrimidin-2-amine
CAS
910904-64-2
Catalog Number
ACM910904642
Category
Other Products
Molecular Weight
329.353760 [g/mol]
Molecular Formula
C16H19N5O3
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
5-nitro-N-(4-(2-(pyrrolidin-1-yl)ethoxy)phenyl)pyrimidin-2-amine, 910904-64-2, SureCN2499009, AKOS016012522, AK126809, KB-246698
IUPAC Name
5-nitro-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine
Canonical SMILES
C1CCN(C1)CCOC2=CC=C(C=C2)NC3=NC=C(C=N3)[N+](=O)[O-]
InChI Key
FJWKTOUIHYOUKL-UHFFFAOYSA-N
Exact Mass
329.14900
H-Bond Acceptor
7
H-Bond Donor
1
What is the molecular formula of the compound with PubChem CID 53486833?
The molecular formula is C16H19N5O3.
What is the molecular weight of the compound?
The molecular weight is 329.35 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 5-nitro-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyrimidin-2-amine.
What is the InChIKey of the compound?
The InChIKey is FJWKTOUIHYOUKL-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 7 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 96.1 Ų.
How many rotatable bond counts does the compound have?
The compound has 6 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the complexity value of the compound?
The complexity value is 384.
Recommended Products
CAS
910908-09-7 Purity
96%
910908-09-7 Purity
96%
