N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide

C19H23N3O2 — CID 71087884

IUPACN-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide
SMILESCNC(=O)[C@@H](NC(=O)c1cccc(-c2ccccc2)n1)C(C)(C)C
InChIInChI=1S/C19H23N3O2/c1-19(2,3)16(18(24)20-4)22-17(23)15-12-8-11-14(21-15)13-9-6-5-7-10-13/h5-12,16H,1-4H3,(H,20,24)(H,22,23)/t16-/m1/s1
InChIKeyUCIUGCJWIQMHEJ-MRXNPFEDSA-N
MW325.41 g/mol
LogP2.64
Rot. Bonds4

About N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide

N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide (PubChem CID 71087884) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide
PubChem CID71087884
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide
SMILESCNC(=O)[C@@H](NC(=O)c1cccc(-c2ccccc2)n1)C(C)(C)C
InChIInChI=1S/C19H23N3O2/c1-19(2,3)16(18(24)20-4)22-17(23)15-12-8-11-14(21-15)13-9-6-5-7-10-13/h5-12,16H,1-4H3,(H,20,24)(H,22,23)/t16-/m1/s1
InChIKeyUCIUGCJWIQMHEJ-MRXNPFEDSA-N
XLogP2.64
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Delanzomib
CID 24800541
(3,3-Dimethylpiperidin-1-yl)(6-(3-fluoro-4-methylphenyl)pyridin-2-yl)methanone
CID 24808495
Bupicomide
CID 31447
Lsn2463359
CID 72551298
2-N,6-N-bis(2,6-dimethylphenyl)pyridine-2,6-dicarboxamide
CID 1010589
Rhazinal
CID 12041235
N-(2-Chloroethyl)-2-quinolinecarboxamide
CID 2305179
4-Pentyl-N-pyridin-3-yl-benzamide
CID 2796370
4-butyl-N-(pyridin-3-yl)benzamide
CID 4286311
Pyridine amide, 27
CID 44237002
3-[6-(But-3-En-1-Yl)-7-Oxo-6,7-Dihydro-1h-Pyrrolo[2,3-C]pyridin-4-Yl]-N,N-Dimethylbenzamide
CID 119081691
N,N-Dimethyl-3-(6-Methyl-7-Oxo-6,7-Dihydro-1h-Pyrrolo[2,3-C]pyridin-4-Yl)benzamide
CID 119081692

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide?
The IUPAC name of N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide (CID 71087884) is N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide.
What is the SMILES notation for N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide?
The canonical SMILES for N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide is CNC(=O)[C@@H](NC(=O)c1cccc(-c2ccccc2)n1)C(C)(C)C.
What is the InChIKey of N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide?
The InChIKey is UCIUGCJWIQMHEJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-19(2,3)16(18(24)20-4)22-17(23)15-12-8-11-14(21-15)13-9-6-5-7-10-13/h5-12,16H,1-4H3,(H,20,24)(H,22,23)/t16-/m1/s1.
What are the key properties of N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide?
N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]-6-phenylpyridine-2-carboxamide is sourced from PubChem (CID 71087884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).