N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide

C13H17NO — CID 6950629

IUPACN-[(1S)-1-cyclopropylethyl]-N-phenylacetamide
SMILESCC(=O)N(c1ccccc1)[C@@H](C)C1CC1
InChIInChI=1S/C13H17NO/c1-10(12-8-9-12)14(11(2)15)13-6-4-3-5-7-13/h3-7,10,12H,8-9H2,1-2H3/t10-/m0/s1
InChIKeyIPPIQXVCIYXHBG-JTQLQIEISA-N
MW203.29 g/mol
LogP2.84
Rot. Bonds3

About N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide

N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide (PubChem CID 6950629) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide.

Molecular Properties

Compound NameN-[(1S)-1-cyclopropylethyl]-N-phenylacetamide
PubChem CID6950629
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC NameN-[(1S)-1-cyclopropylethyl]-N-phenylacetamide
SMILESCC(=O)N(c1ccccc1)[C@@H](C)C1CC1
InChIInChI=1S/C13H17NO/c1-10(12-8-9-12)14(11(2)15)13-6-4-3-5-7-13/h3-7,10,12H,8-9H2,1-2H3/t10-/m0/s1
InChIKeyIPPIQXVCIYXHBG-JTQLQIEISA-N
XLogP2.84
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1-cyclopropylethyl]-N-phenylbenzamide
CID 6923930
(E)-4-(N-[(1R)-1-cyclopropylethyl]anilino)-4-oxobut-2-enoate
CID 7036845
2-[[(1S)-1-cyclopropylethyl]-phenylcarbamoyl]benzoic acid
CID 42108646
N-[(1S)-1-cyclopropylethyl]-4-methyl-N-phenylbenzamide
CID 6923903
(2S)-2-(N-acetylanilino)propanoic acid
CID 821173
N-(1-cyclopropylethyl)-2-nitro-N-phenylbenzamide
CID 4522146
N-(1-cyclopropylethyl)-N-methylaniline
CID 134851823
N-(3,4-dioxopentan-2-yl)-N-phenylacetamide
CID 15339252
3-[1-cyclopropylethyl(methyl)amino]benzoic acid
CID 102822708
1-[(1S)-1-cyclopropylethyl]-3-(3-nitrophenyl)-1-phenylurea
CID 786334
2-[[cyclopropyl(phenyl)methyl]amino]-N-phenyl-N-propan-2-ylacetamide
CID 112806598
phenyl N-(1-cyclopropylethyl)-N-methylcarbamate
CID 60724808

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide?
The IUPAC name of N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide (CID 6950629) is N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide.
What is the SMILES notation for N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide?
The canonical SMILES for N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide is CC(=O)N(c1ccccc1)[C@@H](C)C1CC1.
What is the InChIKey of N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide?
The InChIKey is IPPIQXVCIYXHBG-JTQLQIEISA-N. The full InChI is InChI=1S/C13H17NO/c1-10(12-8-9-12)14(11(2)15)13-6-4-3-5-7-13/h3-7,10,12H,8-9H2,1-2H3/t10-/m0/s1.
What are the key properties of N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide?
N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide has a molecular weight of 203.29 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-cyclopropylethyl]-N-phenylacetamide is sourced from PubChem (CID 6950629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).