2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide

C16H19N3O — CID 113016197

IUPAC2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide
SMILESCc1cccc(Nc2ccc(NC(=O)C(C)C)cn2)c1
InChIInChI=1S/C16H19N3O/c1-11(2)16(20)19-14-7-8-15(17-10-14)18-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,18)(H,19,20)
InChIKeyWRYCPPDOWQEIMH-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.73
Rot. Bonds4

About 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide

2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide (PubChem CID 113016197) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide
PubChem CID113016197
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide
SMILESCc1cccc(Nc2ccc(NC(=O)C(C)C)cn2)c1
InChIInChI=1S/C16H19N3O/c1-11(2)16(20)19-14-7-8-15(17-10-14)18-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,18)(H,19,20)
InChIKeyWRYCPPDOWQEIMH-UHFFFAOYSA-N
XLogP3.73
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-[6-(3-methylanilino)-3-pyridinyl]butanamide
CID 113016204
N-[6-(3,4-dimethylanilino)-3-pyridinyl]-2-methylpropanamide
CID 113016947
N-[6-(3-methylanilino)-3-pyridinyl]-3-oxobutanamide
CID 110179055
N-[6-(3,4-difluoroanilino)-3-pyridinyl]-2-methylpropanamide
CID 113023196
2-methyl-N-[6-(2,4,6-trimethylanilino)-3-pyridinyl]propanamide
CID 113017883
N-[6-(3-methylanilino)-3-pyridinyl]butanamide
CID 113016196
ethane;2-methyl-N-(3-methylphenyl)propanamide
CID 163229096
3-methyl-N-[5-(3-methylanilino)-2-pyridinyl]benzamide
CID 113031421
N-[6-(3,4-dichloroanilino)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113022187
N-[6-(3-chloroanilino)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113018544
2-ethyl-N-[6-(3-fluoroanilino)-3-pyridinyl]butanamide
CID 113021263
N-[6-(3-bromoanilino)-3-pyridinyl]-3-methylbutanamide
CID 113021415

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide?
The IUPAC name of 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide (CID 113016197) is 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide.
What is the SMILES notation for 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide?
The canonical SMILES for 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide is Cc1cccc(Nc2ccc(NC(=O)C(C)C)cn2)c1.
What is the InChIKey of 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide?
The InChIKey is WRYCPPDOWQEIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-11(2)16(20)19-14-7-8-15(17-10-14)18-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,18)(H,19,20).
What are the key properties of 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide?
2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide has a molecular weight of 269.35 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[6-(3-methylanilino)-3-pyridinyl]propanamide is sourced from PubChem (CID 113016197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).