4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide

C16H19N3O — CID 64695920

IUPAC4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide
SMILESCCc1ccccc1CNc1ccnc(C(=O)NC)c1
InChIInChI=1S/C16H19N3O/c1-3-12-6-4-5-7-13(12)11-19-14-8-9-18-15(10-14)16(20)17-2/h4-10H,3,11H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyTWVLNTKKVIKEEM-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.62
Rot. Bonds5

About 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide

4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide (PubChem CID 64695920) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide
PubChem CID64695920
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide
SMILESCCc1ccccc1CNc1ccnc(C(=O)NC)c1
InChIInChI=1S/C16H19N3O/c1-3-12-6-4-5-7-13(12)11-19-14-8-9-18-15(10-14)16(20)17-2/h4-10H,3,11H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyTWVLNTKKVIKEEM-UHFFFAOYSA-N
XLogP2.62
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 ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-hydroxyphenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 114332705
N-methyl-4-[2-(2-methylphenyl)ethylamino]pyridine-2-carboxamide
CID 112722856
4-[(2-bromophenyl)methylamino]-N-ethylpyridine-2-carboxamide
CID 61401901
4-[(2-chlorophenyl)methylamino]-N-ethylpyridine-2-carboxamide
CID 43517871
4-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-methylpyridine-2-carboxamide
CID 106048173
4-[(2-chlorophenyl)methylamino]-N-(4-ethylphenyl)pyridine-2-carboxamide
CID 109211739
4-[(4-aminophenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 60874908
4-[(4-chlorophenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 43395704
4-[(2-chlorophenyl)methylamino]-N-propylpyridine-2-carboxamide
CID 109201013
3-[[[2-(methylcarbamoyl)-4-pyridinyl]amino]methyl]benzoic acid
CID 60893530
N-methyl-4-[2-(propylamino)ethylamino]pyridine-2-carboxamide
CID 62665007
N-methyl-4-[(5-methylpyrazin-2-yl)methylamino]pyridine-2-carboxamide
CID 62845761

Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide (CID 64695920) is 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide is CCc1ccccc1CNc1ccnc(C(=O)NC)c1.
What is the InChIKey of 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide?
The InChIKey is TWVLNTKKVIKEEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-12-6-4-5-7-13(12)11-19-14-8-9-18-15(10-14)16(20)17-2/h4-10H,3,11H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide?
4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethylphenyl)methylamino]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 64695920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).