4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide

C16H19N3O — CID 113023427

IUPAC4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide
SMILESCCCNc1ccc(NC(=O)c2ccc(C)cc2)nc1
InChIInChI=1S/C16H19N3O/c1-3-10-17-14-8-9-15(18-11-14)19-16(20)13-6-4-12(2)5-7-13/h4-9,11,17H,3,10H2,1-2H3,(H,18,19,20)
InChIKeyDWCIFKHZAJDPMY-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.46
Rot. Bonds5

About 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide

4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide (PubChem CID 113023427) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide
PubChem CID113023427
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide
SMILESCCCNc1ccc(NC(=O)c2ccc(C)cc2)nc1
InChIInChI=1S/C16H19N3O/c1-3-10-17-14-8-9-15(18-11-14)19-16(20)13-6-4-12(2)5-7-13/h4-9,11,17H,3,10H2,1-2H3,(H,18,19,20)
InChIKeyDWCIFKHZAJDPMY-UHFFFAOYSA-N
XLogP3.46
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[5-(3-methylbutylamino)-2-pyridinyl]benzamide
CID 113030264
N-[5-[2-(4-chlorophenyl)ethylamino]-2-pyridinyl]-4-methylbenzamide
CID 113029009
4-(ethylamino)-N-(5-methyl-2-pyridinyl)benzamide
CID 62172642
N-[6-(ethylamino)-3-pyridinyl]-4-methylbenzamide
CID 115268582
3,4-dimethoxy-N-[5-(propylamino)-2-pyridinyl]benzamide
CID 113023443
4-chloro-N-[5-(pentylamino)-2-pyridinyl]benzamide
CID 113030423
4-bromo-N-[5-(butylamino)-2-pyridinyl]benzamide
CID 113023973
2-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide
CID 113023425
N-[5-[2-(2-methoxyphenyl)ethylamino]-2-pyridinyl]-4-methylbenzamide
CID 113028340
N-[5-(propylamino)-2-pyridinyl]propanamide
CID 113023412
N-[5-(butylamino)-2-pyridinyl]-3-methylbenzamide
CID 113023966
4-methyl-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011759

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide?
The IUPAC name of 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide (CID 113023427) is 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide.
What is the SMILES notation for 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide?
The canonical SMILES for 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide is CCCNc1ccc(NC(=O)c2ccc(C)cc2)nc1.
What is the InChIKey of 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide?
The InChIKey is DWCIFKHZAJDPMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-10-17-14-8-9-15(18-11-14)19-16(20)13-6-4-12(2)5-7-13/h4-9,11,17H,3,10H2,1-2H3,(H,18,19,20).
What are the key properties of 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide?
4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide has a molecular weight of 269.35 g/mol, XLogP of 3.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[5-(propylamino)-2-pyridinyl]benzamide is sourced from PubChem (CID 113023427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).