2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide

C17H21N3O — CID 113026479

IUPAC2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
SMILESCc1ccccc1CNc1ccc(NC(=O)C(C)C)nc1
InChIInChI=1S/C17H21N3O/c1-12(2)17(21)20-16-9-8-15(11-19-16)18-10-14-7-5-4-6-13(14)3/h4-9,11-12,18H,10H2,1-3H3,(H,19,20,21)
InChIKeyQUGAXRGLJZJESE-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.60
Rot. Bonds5

About 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide

2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide (PubChem CID 113026479) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
PubChem CID113026479
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
SMILESCc1ccccc1CNc1ccc(NC(=O)C(C)C)nc1
InChIInChI=1S/C17H21N3O/c1-12(2)17(21)20-16-9-8-15(11-19-16)18-10-14-7-5-4-6-13(14)3/h4-9,11-12,18H,10H2,1-3H3,(H,19,20,21)
InChIKeyQUGAXRGLJZJESE-UHFFFAOYSA-N
XLogP3.60
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026477
2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide
CID 113024145
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]cyclobutanecarboxamide
CID 113026538
N-[5-(2-ethyl-6-methylanilino)-2-pyridinyl]-2-methylpropanamide
CID 113032651
N-[5-(butan-2-ylamino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113024277
2-(2-methylphenyl)-N-[5-[(3-methylphenyl)methylamino]-2-pyridinyl]acetamide
CID 113026630
N-[5-(2-methylanilino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113031347
N-[5-[(2-chlorophenyl)methylamino]-2-pyridinyl]-3-methylbutanamide
CID 113027171
N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]cyclopropanecarboxamide
CID 113011542
4-methyl-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011554
5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109188310
N-[5-[(4-methoxyphenyl)methylamino]-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113027443

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide?
The IUPAC name of 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide (CID 113026479) is 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide.
What is the SMILES notation for 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide?
The canonical SMILES for 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide is Cc1ccccc1CNc1ccc(NC(=O)C(C)C)nc1.
What is the InChIKey of 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide?
The InChIKey is QUGAXRGLJZJESE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-12(2)17(21)20-16-9-8-15(11-19-16)18-10-14-7-5-4-6-13(14)3/h4-9,11-12,18H,10H2,1-3H3,(H,19,20,21).
What are the key properties of 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide?
2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide has a molecular weight of 283.38 g/mol, XLogP of 3.60, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide is sourced from PubChem (CID 113026479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).