6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide

C13H13ClN4O — CID 62153756

IUPAC6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide
SMILESNc1ccc(Cl)c(C(=O)NCCc2ccccn2)n1
InChIInChI=1S/C13H13ClN4O/c14-10-4-5-11(15)18-12(10)13(19)17-8-6-9-3-1-2-7-16-9/h1-5,7H,6,8H2,(H2,15,18)(H,17,19)
InChIKeyIHQNJEDYFMUYHT-UHFFFAOYSA-N
MW276.73 g/mol
LogP1.68
Rot. Bonds4

About 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide

6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide (PubChem CID 62153756) has the molecular formula C13H13ClN4O and a molecular weight of 276.73 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide
PubChem CID62153756
Molecular FormulaC13H13ClN4O
Molecular Weight276.73 g/mol
Exact Mass276.08
IUPAC Name6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide
SMILESNc1ccc(Cl)c(C(=O)NCCc2ccccn2)n1
InChIInChI=1S/C13H13ClN4O/c14-10-4-5-11(15)18-12(10)13(19)17-8-6-9-3-1-2-7-16-9/h1-5,7H,6,8H2,(H2,15,18)(H,17,19)
InChIKeyIHQNJEDYFMUYHT-UHFFFAOYSA-N
XLogP1.68
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.73
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-(2-pyridin-2-ylethyl)pyridazine-3-carboxamide
CID 62152173
N-(2-pyridin-2-ylethyl)isoquinoline-1-carboxamide
CID 171674202
6-amino-N-(4-amino-4-oxobutyl)-3-chloropyridine-2-carboxamide
CID 55041650
2,5-dichloro-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 114917187
2-chloro-5-methylsulfanyl-N-(2-pyridin-2-ylethyl)benzamide
CID 4783071
3-amino-N-(2-pyridin-2-ylethyl)benzamide
CID 24704285
6-amino-3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 82744378
2-chloro-6-hydrazinyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 62236748
3-chloro-6-(methylamino)-N-(pyridin-2-ylmethyl)pyridine-2-carboxamide
CID 62166943
3,4-dichloro-N-(3-pyridin-2-ylpropyl)benzamide
CID 110660973
2,4-diamino-N-(2-pyridin-2-ylethyl)benzamide
CID 61095096
5-chloro-2-hydrazinyl-N-(2-pyridin-2-ylethyl)benzamide
CID 62236376

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide (CID 62153756) is 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide is Nc1ccc(Cl)c(C(=O)NCCc2ccccn2)n1.
What is the InChIKey of 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide?
The InChIKey is IHQNJEDYFMUYHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4O/c14-10-4-5-11(15)18-12(10)13(19)17-8-6-9-3-1-2-7-16-9/h1-5,7H,6,8H2,(H2,15,18)(H,17,19).
What are the key properties of 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide?
6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide has a molecular weight of 276.73 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(2-pyridin-2-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62153756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).