N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide

C16H19N3O — CID 109179331

IUPACN-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)N(C)c2ccccc2)nc1
InChIInChI=1S/C16H19N3O/c1-3-11-17-13-9-10-15(18-12-13)16(20)19(2)14-7-5-4-6-8-14/h4-10,12,17H,3,11H2,1-2H3
InChIKeyOTWOEXIWSXWPAX-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.18
Rot. Bonds5

About N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide

N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide (PubChem CID 109179331) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide
PubChem CID109179331
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)N(C)c2ccccc2)nc1
InChIInChI=1S/C16H19N3O/c1-3-11-17-13-9-10-15(18-12-13)16(20)19(2)14-7-5-4-6-8-14/h4-10,12,17H,3,11H2,1-2H3
InChIKeyOTWOEXIWSXWPAX-UHFFFAOYSA-N
XLogP3.18
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(dimethylamino)ethylamino]-N-methyl-N-phenylpyridine-2-carboxamide
CID 109185536
N-methyl-N-(3-methylphenyl)-5-(propylamino)pyridine-2-carboxamide
CID 104640621
N-methyl-N-phenyl-5-(propylamino)pyrazine-2-carboxamide
CID 109271049
5-[2-(4-chlorophenyl)ethylamino]-N-methyl-N-phenylpyridine-2-carboxamide
CID 109193694
N-methyl-5-[(2-methylphenyl)methylamino]-N-phenylpyridine-2-carboxamide
CID 109188298
N-methyl-N-phenyl-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191642
5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197592
N-ethyl-5-(pentylamino)-N-phenylpyridine-2-carboxamide
CID 109195842
N-(2-hydroxy-2-methylpropyl)-N-methyl-5-(propylamino)pyridine-2-carboxamide
CID 104641727
5-(3,5-dimethylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197567
5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197604
5-(3,5-dichloroanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197632

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide (CID 109179331) is N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide is CCCNc1ccc(C(=O)N(C)c2ccccc2)nc1.
What is the InChIKey of N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide?
The InChIKey is OTWOEXIWSXWPAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-11-17-13-9-10-15(18-12-13)16(20)19(2)14-7-5-4-6-8-14/h4-10,12,17H,3,11H2,1-2H3.
What are the key properties of N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide?
N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109179331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).