2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide

C13H16N6O — CID 64822462

IUPAC2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)Nc1cccnc1-n1cncn1
InChIInChI=1S/C13H16N6O/c14-10-4-1-3-9(10)13(20)18-11-5-2-6-16-12(11)19-8-15-7-17-19/h2,5-10H,1,3-4,14H2,(H,18,20)
InChIKeyGFSQLZDWUAUMFQ-UHFFFAOYSA-N
MW272.31 g/mol
LogP0.73
Rot. Bonds3

About 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide

2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide (PubChem CID 64822462) has the molecular formula C13H16N6O and a molecular weight of 272.31 g/mol. Its IUPAC name is 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide
PubChem CID64822462
Molecular FormulaC13H16N6O
Molecular Weight272.31 g/mol
Exact Mass272.14
IUPAC Name2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)Nc1cccnc1-n1cncn1
InChIInChI=1S/C13H16N6O/c14-10-4-1-3-9(10)13(20)18-11-5-2-6-16-12(11)19-8-15-7-17-19/h2,5-10H,1,3-4,14H2,(H,18,20)
InChIKeyGFSQLZDWUAUMFQ-UHFFFAOYSA-N
XLogP0.73
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]pyrrolidine-3-carboxamide
CID 79388465
(2S)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]pyrrolidine-2-carboxamide
CID 61169536
2-amino-N-(2-chloro-3-pyridinyl)cyclohexane-1-carboxamide
CID 64822363
(2S)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]piperidine-2-carboxamide
CID 104913644
(2R)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]piperidine-2-carboxamide
CID 104913643
2-amino-N-[4-(1,2,4-triazol-1-yl)phenyl]cyclohexane-1-carboxamide
CID 64822786
N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]adamantane-2-carboxamide
CID 167868250
2-amino-1-methyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide
CID 82758704
4-methyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]piperidine-2-carboxamide
CID 114423652
2-amino-N-quinolin-5-ylcyclohexane-1-carboxamide
CID 64817918
2-amino-N-(2-pyrazol-1-ylphenyl)cyclohexane-1-carboxamide
CID 64824714
2-amino-N-(2-hydroxyphenyl)cyclopentane-1-carboxamide
CID 64852235

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide (CID 64822462) is 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide is NC1CCCC1C(=O)Nc1cccnc1-n1cncn1.
What is the InChIKey of 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide?
The InChIKey is GFSQLZDWUAUMFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O/c14-10-4-1-3-9(10)13(20)18-11-5-2-6-16-12(11)19-8-15-7-17-19/h2,5-10H,1,3-4,14H2,(H,18,20).
What are the key properties of 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide?
2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64822462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).