N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide

C19H23NO2 — CID 131985605

IUPACN-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide
SMILESCC(C)CC(CO)NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C19H23NO2/c1-14(2)12-16(13-21)20-19(22)18-11-7-6-10-17(18)15-8-4-3-5-9-15/h3-11,14,16,21H,12-13H2,1-2H3,(H,20,22)
InChIKeyKUODGQVOWBRNCF-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.49
Rot. Bonds6

About N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide

N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide (PubChem CID 131985605) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide
PubChem CID131985605
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide
SMILESCC(C)CC(CO)NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C19H23NO2/c1-14(2)12-16(13-21)20-19(22)18-11-7-6-10-17(18)15-8-4-3-5-9-15/h3-11,14,16,21H,12-13H2,1-2H3,(H,20,22)
InChIKeyKUODGQVOWBRNCF-UHFFFAOYSA-N
XLogP3.49
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3R)-1-(5-chloro-2-pyridinyl)-5-methylhexan-3-yl]-2-phenylbenzamide
CID 160860689
N-(1-hydroxy-4-methylpentan-2-yl)-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide
CID 118917738
N-[(2S)-1-amino-3-methylbutan-2-yl]-2-phenylbenzamide
CID 68724562
2-fluoro-N-(1-hydroxy-4-methylpentan-2-yl)pyridine-3-carboxamide
CID 107358920
N-[(2R)-1-amino-3-phenylpropan-2-yl]-2-phenylbenzamide
CID 68724752
4-chloro-N-[(2R)-1-hydroxy-4-methylpentan-2-yl]benzamide
CID 39357973
2-[(2-phenylbenzoyl)amino]-3-sulfanylpropanoic acid
CID 87373520
N-(1-hydroxy-4-methylpentan-2-yl)-2-phenoxyacetamide
CID 61245289
N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide
CID 68727278
N-(1-hydroxy-4-methylpentan-2-yl)-4-oxo-1H-quinoline-3-carboxamide
CID 61246049
2,6-difluoro-N-(1-hydroxy-4-methylpentan-2-yl)benzamide
CID 61247337
(2S)-N-[(2S)-1-hydroxy-4-methylpentan-2-yl]-2-(methylamino)-3-phenylpropanamide
CID 70540620

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide (CID 131985605) is N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide is CC(C)CC(CO)NC(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide?
The InChIKey is KUODGQVOWBRNCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-14(2)12-16(13-21)20-19(22)18-11-7-6-10-17(18)15-8-4-3-5-9-15/h3-11,14,16,21H,12-13H2,1-2H3,(H,20,22).
What are the key properties of N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide?
N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide has a molecular weight of 297.40 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide is sourced from PubChem (CID 131985605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).