2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide

C17H20N2O2 — CID 58860970

IUPAC2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide
SMILESCc1ccc(NC(=O)C(C)(O)CCc2ccccn2)cc1
InChIInChI=1S/C17H20N2O2/c1-13-6-8-15(9-7-13)19-16(20)17(2,21)11-10-14-5-3-4-12-18-14/h3-9,12,21H,10-11H2,1-2H3,(H,19,20)
InChIKeyQVOGVLBZJSVGQR-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.71
Rot. Bonds5

About 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide

2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide (PubChem CID 58860970) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide
PubChem CID58860970
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide
SMILESCc1ccc(NC(=O)C(C)(O)CCc2ccccn2)cc1
InChIInChI=1S/C17H20N2O2/c1-13-6-8-15(9-7-13)19-16(20)17(2,21)11-10-14-5-3-4-12-18-14/h3-9,12,21H,10-11H2,1-2H3,(H,19,20)
InChIKeyQVOGVLBZJSVGQR-UHFFFAOYSA-N
XLogP2.71
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methylphenyl)-3-(2-pyridin-2-ylethyl)urea
CID 770306
2-methyl-4-pyridin-2-ylbutan-2-ol
CID 145217393
2-(4-methylphenyl)-N-[4-(2-pyridin-2-ylethylamino)phenyl]benzamide
CID 10158321
2,2-dimethyl-N-[(4-methylphenyl)methyl]-N'-(pyridin-2-ylmethyl)propanediamide
CID 108961962
(2S)-2-hydroxy-2-methyl-3-(4-methylphenoxy)-N-(4-methylphenyl)propanamide
CID 58594527
2-hydroxy-2-methyl-3-(4-methylphenoxy)-N-(4-methylphenyl)propanamide
CID 23596876
2-amino-2-methyl-N-phenyl-3-pyridin-2-ylpropanamide
CID 68993510
N-(4-ethylphenyl)-2,2-dimethyl-N'-(pyridin-2-ylmethyl)propanediamide
CID 108963397
(3S)-3-methyl-5-pyridin-2-ylpent-1-en-3-ol
CID 92532437
N-(4-methylphenyl)-4-(pyridin-2-ylmethylamino)pyridine-2-carboxamide
CID 109212856
methyl N-[4-(pyridin-2-ylmethylamino)phenyl]carbamate
CID 43730278
N-(4-methylphenyl)-4-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 17184500

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide (CID 58860970) is 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide is Cc1ccc(NC(=O)C(C)(O)CCc2ccccn2)cc1.
What is the InChIKey of 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide?
The InChIKey is QVOGVLBZJSVGQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-13-6-8-15(9-7-13)19-16(20)17(2,21)11-10-14-5-3-4-12-18-14/h3-9,12,21H,10-11H2,1-2H3,(H,19,20).
What are the key properties of 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide?
2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide has a molecular weight of 284.36 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-(4-methylphenyl)-4-pyridin-2-ylbutanamide is sourced from PubChem (CID 58860970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).