N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide

C17H17N3O3 — CID 18160954

IUPACN-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide
SMILESCC(=O)c1cccc(NC(=O)CNC(=O)Nc2ccccc2)c1
InChIInChI=1S/C17H17N3O3/c1-12(21)13-6-5-9-15(10-13)19-16(22)11-18-17(23)20-14-7-3-2-4-8-14/h2-10H,11H2,1H3,(H,19,22)(H2,18,20,23)
InChIKeyJAXUZVFQJFTLCZ-UHFFFAOYSA-N
MW311.34 g/mol
LogP2.65
Rot. Bonds5

About N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide

N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide (PubChem CID 18160954) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide
PubChem CID18160954
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC NameN-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide
SMILESCC(=O)c1cccc(NC(=O)CNC(=O)Nc2ccccc2)c1
InChIInChI=1S/C17H17N3O3/c1-12(21)13-6-5-9-15(10-13)19-16(22)11-18-17(23)20-14-7-3-2-4-8-14/h2-10H,11H2,1H3,(H,19,22)(H2,18,20,23)
InChIKeyJAXUZVFQJFTLCZ-UHFFFAOYSA-N
XLogP2.65
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-acetylanilino)-2-oxoethyl]-3-methylbutanamide
CID 112999507
N-[2-(3-acetylanilino)-2-oxoethyl]-4-methylbenzamide
CID 34830762
2-[(3-acetylphenyl)carbamoylamino]-N-quinolin-8-ylacetamide
CID 52842232
(2R)-2-[[2-(3-acetylanilino)-2-oxoethyl]amino]propanoic acid
CID 83194431
N-(3,4-difluorophenyl)-2-(phenylcarbamoylamino)acetamide
CID 17451179
N-(3-acetylphenyl)propanamide
CID 903063
N-(3-acetylphenyl)-2-(tert-butylamino)acetamide
CID 31628083
N-(3-acetylphenyl)-2-(prop-2-enylamino)acetamide
CID 78908291
N'-(3-acetylphenyl)-N-benzylpropanediamide
CID 108945305
N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 2968363
3-[(3-acetylphenyl)carbamoylamino]-N-propylpropanamide
CID 61066520
N-[2-(3-acetylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705505

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide (CID 18160954) is N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide is CC(=O)c1cccc(NC(=O)CNC(=O)Nc2ccccc2)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide?
The InChIKey is JAXUZVFQJFTLCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-12(21)13-6-5-9-15(10-13)19-16(22)11-18-17(23)20-14-7-3-2-4-8-14/h2-10H,11H2,1H3,(H,19,22)(H2,18,20,23).
What are the key properties of N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide?
N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide has a molecular weight of 311.34 g/mol, XLogP of 2.65, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-(phenylcarbamoylamino)acetamide is sourced from PubChem (CID 18160954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).