2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide

C14H15ClN4O — CID 62171208

IUPAC2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NCCc2ccccn2)cc(Cl)n1
InChIInChI=1S/C14H15ClN4O/c1-16-13-9-10(8-12(15)19-13)14(20)18-7-5-11-4-2-3-6-17-11/h2-4,6,8-9H,5,7H2,1H3,(H,16,19)(H,18,20)
InChIKeyGJSWUMQPJWRCNW-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.14
Rot. Bonds5

About 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide

2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide (PubChem CID 62171208) has the molecular formula C14H15ClN4O and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
PubChem CID62171208
Molecular FormulaC14H15ClN4O
Molecular Weight290.75 g/mol
Exact Mass290.09
IUPAC Name2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NCCc2ccccn2)cc(Cl)n1
InChIInChI=1S/C14H15ClN4O/c1-16-13-9-10(8-12(15)19-13)14(20)18-7-5-11-4-2-3-6-17-11/h2-4,6,8-9H,5,7H2,1H3,(H,16,19)(H,18,20)
InChIKeyGJSWUMQPJWRCNW-UHFFFAOYSA-N
XLogP2.14
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-hydrazinyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 62236748
2-chloro-6-(methylamino)-N-(2-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 62167624
2-chloro-6-(methylamino)-N-(2-pyrazol-1-ylethyl)pyridine-4-carboxamide
CID 62178675
N-(4-amino-4-oxobutyl)-2-chloro-6-(methylamino)pyridine-4-carboxamide
CID 62179327
2-chloro-N-methyl-6-(methylamino)-N-pyridin-2-ylpyridine-4-carboxamide
CID 62172641
3,4-dichloro-N-(3-pyridin-2-ylpropyl)benzamide
CID 110660973
2-(hydroxymethyl)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115116136
2,5-dichloro-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 114917187
2-chloro-6-(methylamino)-N-phenylpyridine-4-carboxamide
CID 55042308
3-amino-N-(2-pyridin-2-ylethyl)benzamide
CID 24704285
N-(3-butoxypropyl)-2-chloro-6-(methylamino)pyridine-4-carboxamide
CID 115620351
2-chloro-6-(pyridin-2-ylmethylamino)pyridine-4-carboxylic acid
CID 43343491

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide (CID 62171208) is 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide is CNc1cc(C(=O)NCCc2ccccn2)cc(Cl)n1.
What is the InChIKey of 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
The InChIKey is GJSWUMQPJWRCNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN4O/c1-16-13-9-10(8-12(15)19-13)14(20)18-7-5-11-4-2-3-6-17-11/h2-4,6,8-9H,5,7H2,1H3,(H,16,19)(H,18,20).
What are the key properties of 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide?
2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide has a molecular weight of 290.75 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(methylamino)-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide is sourced from PubChem (CID 62171208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).