5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide

C15H17ClN4O — CID 62170701

IUPAC5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncc(C(=O)Nc2cccc(C)n2)cc1Cl
InChIInChI=1S/C15H17ClN4O/c1-3-7-17-14-12(16)8-11(9-18-14)15(21)20-13-6-4-5-10(2)19-13/h4-6,8-9H,3,7H2,1-2H3,(H,17,18)(H,19,20,21)
InChIKeyBAVBKQOGHPLBRZ-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.51
Rot. Bonds5

About 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide

5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide (PubChem CID 62170701) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide
PubChem CID62170701
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncc(C(=O)Nc2cccc(C)n2)cc1Cl
InChIInChI=1S/C15H17ClN4O/c1-3-7-17-14-12(16)8-11(9-18-14)15(21)20-13-6-4-5-10(2)19-13/h4-6,8-9H,3,7H2,1-2H3,(H,17,18)(H,19,20,21)
InChIKeyBAVBKQOGHPLBRZ-UHFFFAOYSA-N
XLogP3.51
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(3-chlorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 25176417
5-bromo-N-(6-methyl-2-pyridinyl)-2-(propylamino)pyridine-3-carboxamide
CID 62172279
N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 62166024
5-chloro-6-(propylamino)-N-thiophen-3-ylpyridine-3-carboxamide
CID 66355264
N-tert-butyl-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 62171459
N-(6-methyl-2-pyridinyl)-2-(propylamino)pyridine-3-carboxamide
CID 62171746
5-chloro-N-cyclobutyl-6-(propylamino)pyridine-3-carboxamide
CID 62414075
5-chloro-6-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 62172627
3-chloro-N-(6-methyl-2-pyridinyl)-4-nitrobenzamide
CID 82780242
4-chloro-6-methyl-N-(6-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 81225554
5-chloro-N-piperidin-1-yl-6-(propylamino)pyridine-3-carboxamide
CID 83023979
N-(6-methyl-2-pyridinyl)-4-(propylamino)pyridine-3-carboxamide
CID 81235208

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide (CID 62170701) is 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide is CCCNc1ncc(C(=O)Nc2cccc(C)n2)cc1Cl.
What is the InChIKey of 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is BAVBKQOGHPLBRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-3-7-17-14-12(16)8-11(9-18-14)15(21)20-13-6-4-5-10(2)19-13/h4-6,8-9H,3,7H2,1-2H3,(H,17,18)(H,19,20,21).
What are the key properties of 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide?
5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 304.78 g/mol, XLogP of 3.51, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62170701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).