N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide

C17H19N3O2 — CID 155944690

IUPACN,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCc1ccc(C(=O)N(C)CC(=O)Nc2cc(C)ccn2)cc1
InChIInChI=1S/C17H19N3O2/c1-12-4-6-14(7-5-12)17(22)20(3)11-16(21)19-15-10-13(2)8-9-18-15/h4-10H,11H2,1-3H3,(H,18,19,21)
InChIKeyVBGVELQAMFKFPC-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.41
Rot. Bonds4

About N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide

N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide (PubChem CID 155944690) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
PubChem CID155944690
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCc1ccc(C(=O)N(C)CC(=O)Nc2cc(C)ccn2)cc1
InChIInChI=1S/C17H19N3O2/c1-12-4-6-14(7-5-12)17(22)20(3)11-16(21)19-15-10-13(2)8-9-18-15/h4-10H,11H2,1-3H3,(H,18,19,21)
InChIKeyVBGVELQAMFKFPC-UHFFFAOYSA-N
XLogP2.41
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[methyl(methylsulfonyl)amino]-N-(4-methyl-2-pyridinyl)acetamide
CID 47351627
N-methyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]cyclopentanecarboxamide
CID 166182865
2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(4-methyl-2-pyridinyl)acetamide
CID 51075766
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-phenylbenzamide
CID 9494059
4-tert-butyl-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 40728961
N-[2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]-2-oxo-1-phenylethyl]benzamide
CID 56523143
methyl (2S)-2-[methyl-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]amino]propanoate
CID 95294721
3-(benzenesulfonylmethyl)-N-methyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 51133835
3,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide
CID 18106925
2-fluoro-N-methyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]-5-(propan-2-ylsulfamoyl)benzamide
CID 56523214
N-[(4-methylphenyl)methyl]-N'-(4-methyl-2-pyridinyl)oxamide
CID 44999915
N-methyl-N-[2-[(5-methyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]benzamide
CID 47289765

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide (CID 155944690) is N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide is Cc1ccc(C(=O)N(C)CC(=O)Nc2cc(C)ccn2)cc1.
What is the InChIKey of N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
The InChIKey is VBGVELQAMFKFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-12-4-6-14(7-5-12)17(22)20(3)11-16(21)19-15-10-13(2)8-9-18-15/h4-10H,11H2,1-3H3,(H,18,19,21).
What are the key properties of N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide?
N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide has a molecular weight of 297.36 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[2-[(4-methyl-2-pyridinyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 155944690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).