N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide

C20H24N2O3 — CID 125463843

IUPACN-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide
SMILESCCC[C@H](CO)NCC(=O)Nc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O3/c1-2-6-18(14-23)21-13-19(24)22-17-11-9-16(10-12-17)20(25)15-7-4-3-5-8-15/h3-5,7-12,18,21,23H,2,6,13-14H2,1H3,(H,22,24)/t18-/m1/s1
InChIKeyTUMBNJAPUGWEOZ-GOSISDBHSA-N
MW340.42 g/mol
LogP2.61
Rot. Bonds9

About N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide

N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide (PubChem CID 125463843) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide.

Molecular Properties

Compound NameN-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide
PubChem CID125463843
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide
SMILESCCC[C@H](CO)NCC(=O)Nc1ccc(C(=O)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O3/c1-2-6-18(14-23)21-13-19(24)22-17-11-9-16(10-12-17)20(25)15-7-4-3-5-8-15/h3-5,7-12,18,21,23H,2,6,13-14H2,1H3,(H,22,24)/t18-/m1/s1
InChIKeyTUMBNJAPUGWEOZ-GOSISDBHSA-N
XLogP2.61
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-hydroxybutan-2-ylamino)-N-(4-methylphenyl)acetamide
CID 43389753
2-[[2-(4-chloroanilino)-2-oxoethyl]amino]pentanoic acid
CID 43631680
2-[[2-(4-carbamoylanilino)-2-oxoethyl]amino]propanoic acid
CID 43467013
N-benzyl-2-(heptan-4-ylamino)acetamide
CID 54881646
propyl 4-[[2-(1-phenylethylamino)acetyl]amino]benzoate
CID 54814917
N-(4-benzoylphenyl)-2-(2,6-dimethylphenoxy)acetamide
CID 1020136
N-(4-benzoylphenyl)-2-(4-methylphenoxy)acetamide
CID 837401
2-[2-(2-hydroxyethyl)pentylamino]-N-phenylacetamide
CID 106115428
2-[[(2S)-1-hydroxypentan-2-yl]amino]-N-[2-(3-methylphenoxy)phenyl]acetamide
CID 59062971
N-(4-benzoylphenyl)-2,3-dichloropropanamide
CID 57282831
2-[[(2S)-5-methylhexan-2-yl]amino]-N-phenylacetamide
CID 95357768
N-phenyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 8898362

Frequently Asked Questions

What is the IUPAC name of N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide?
The IUPAC name of N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide (CID 125463843) is N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide.
What is the SMILES notation for N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide?
The canonical SMILES for N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide is CCC[C@H](CO)NCC(=O)Nc1ccc(C(=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide?
The InChIKey is TUMBNJAPUGWEOZ-GOSISDBHSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-2-6-18(14-23)21-13-19(24)22-17-11-9-16(10-12-17)20(25)15-7-4-3-5-8-15/h3-5,7-12,18,21,23H,2,6,13-14H2,1H3,(H,22,24)/t18-/m1/s1.
What are the key properties of N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide?
N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide has a molecular weight of 340.42 g/mol, XLogP of 2.61, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-benzoylphenyl)-2-[[(2R)-1-hydroxypentan-2-yl]amino]acetamide is sourced from PubChem (CID 125463843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).