N-acetyl-2-phenylpropanamide

C11H13NO2 — CID 134890422

IUPACN-acetyl-2-phenylpropanamide
SMILESCC(=O)NC(=O)C(C)c1ccccc1
InChIInChI=1S/C11H13NO2/c1-8(11(14)12-9(2)13)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,12,13,14)
InChIKeyRZKDNQLWFPZKFY-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.45
Rot. Bonds2

About N-acetyl-2-phenylpropanamide

N-acetyl-2-phenylpropanamide (PubChem CID 134890422) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is N-acetyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-acetyl-2-phenylpropanamide
PubChem CID134890422
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC NameN-acetyl-2-phenylpropanamide
SMILESCC(=O)NC(=O)C(C)c1ccccc1
InChIInChI=1S/C11H13NO2/c1-8(11(14)12-9(2)13)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,12,13,14)
InChIKeyRZKDNQLWFPZKFY-UHFFFAOYSA-N
XLogP1.45
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-phenyl-N-sulfanylpropanamide
CID 146642681
(2S)-2-phenyl-N-[(1S)-1-phenylethyl]propanamide
CID 92978612
(2R)-N-methoxy-2-phenylpropanamide
CID 131067254
bis(3-phenylbutan-2-one);2-phenylpropanoic acid
CID 143307414
N-acetyl-2-[4-(2-methoxyethoxy)phenyl]propanamide
CID 71176755
2-phenyl-N-prop-2-ynylpropanamide
CID 104916558
2-phenylpropanoic acid;hydrate
CID 139796091
methane;(2R)-2-phenylpropanoic acid
CID 162174165
2-phenylpropanoic acid;dihydrochloride
CID 162109025
2-methyl-3-phenyl-3-(2-phenylpropanoylamino)propanoic acid
CID 120686881
N-butyl-2-phenylpropanamide
CID 101453557
(2R)-N-(2,3-dichlorophenyl)-2-phenylpropanamide
CID 97038158

Frequently Asked Questions

What is the IUPAC name of N-acetyl-2-phenylpropanamide?
The IUPAC name of N-acetyl-2-phenylpropanamide (CID 134890422) is N-acetyl-2-phenylpropanamide.
What is the SMILES notation for N-acetyl-2-phenylpropanamide?
The canonical SMILES for N-acetyl-2-phenylpropanamide is CC(=O)NC(=O)C(C)c1ccccc1.
What is the InChIKey of N-acetyl-2-phenylpropanamide?
The InChIKey is RZKDNQLWFPZKFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-8(11(14)12-9(2)13)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,12,13,14).
What are the key properties of N-acetyl-2-phenylpropanamide?
N-acetyl-2-phenylpropanamide has a molecular weight of 191.23 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-2-phenylpropanamide is sourced from PubChem (CID 134890422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).