N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide

C15H18N4O — CID 104641367

IUPACN-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2ccncc2C)nc1
InChIInChI=1S/C15H18N4O/c1-3-7-17-12-4-5-14(18-10-12)15(20)19-13-6-8-16-9-11(13)2/h4-6,8-10,17H,3,7H2,1-2H3,(H,16,19,20)
InChIKeyAQXJHIMQTSRWRK-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.86
Rot. Bonds5

About N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide

N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide (PubChem CID 104641367) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide
PubChem CID104641367
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2ccncc2C)nc1
InChIInChI=1S/C15H18N4O/c1-3-7-17-12-4-5-14(18-10-12)15(20)19-13-6-8-16-9-11(13)2/h4-6,8-10,17H,3,7H2,1-2H3,(H,16,19,20)
InChIKeyAQXJHIMQTSRWRK-UHFFFAOYSA-N
XLogP2.86
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluoro-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide
CID 107595450
N-(3-bromo-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide
CID 104641936
N-(2-methyl-3-pyridinyl)-5-(propylamino)pyridine-2-carboxamide
CID 104641691
N-(2-bromo-3-methylphenyl)-5-(propylamino)pyridine-2-carboxamide
CID 104641911
N-(3-methyl-4-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 63670386
5-(aminomethyl)-N-(3-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 63723889
N-(3-chloro-2-methylphenyl)-5-(propylamino)pyridine-2-carboxamide
CID 109179356
N-(4-chloro-2-methylphenyl)-5-(pentylamino)pyridine-2-carboxamide
CID 109195856
N-(2,5-difluorophenyl)-5-(propylamino)pyridine-2-carboxamide
CID 104639737
5-(propylamino)-N-thiophen-3-ylpyridine-2-carboxamide
CID 104641679
N-(2-methoxyphenyl)-5-(propylamino)pyridine-2-carboxamide
CID 109179366
5-(ethylamino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 104640059

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide (CID 104641367) is N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide is CCCNc1ccc(C(=O)Nc2ccncc2C)nc1.
What is the InChIKey of N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide?
The InChIKey is AQXJHIMQTSRWRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-3-7-17-12-4-5-14(18-10-12)15(20)19-13-6-8-16-9-11(13)2/h4-6,8-10,17H,3,7H2,1-2H3,(H,16,19,20).
What are the key properties of N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide?
N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-4-pyridinyl)-5-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104641367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).