N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide

C10H11NO2 — CID 130699282

IUPACN-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide
SMILESC[C@@H](NC=O)C(=O)c1ccccc1
InChIInChI=1S/C10H11NO2/c1-8(11-7-12)10(13)9-5-3-2-4-6-9/h2-8H,1H3,(H,11,12)/t8-/m1/s1
InChIKeyOFKFNAQOHGEOIG-MRVPVSSYSA-N
MW177.20 g/mol
LogP1.00
Rot. Bonds4

About N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide

N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide (PubChem CID 130699282) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide.

Molecular Properties

Compound NameN-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide
PubChem CID130699282
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC NameN-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide
SMILESC[C@@H](NC=O)C(=O)c1ccccc1
InChIInChI=1S/C10H11NO2/c1-8(11-7-12)10(13)9-5-3-2-4-6-9/h2-8H,1H3,(H,11,12)/t8-/m1/s1
InChIKeyOFKFNAQOHGEOIG-MRVPVSSYSA-N
XLogP1.00
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

1-formamidoethyl benzoate
CID 175311780
2-anilino-1-phenylpropan-1-one
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(2S)-2-methyl-3-oxo-3-phenylpropanal
CID 93475619
N-(1-phenacyloxyethyl)formamide
CID 57086495
1-phenyl-2-(1-phenylethylamino)propan-1-one;hydrochloride
CID 155432915
N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide
CID 13293562
propan-2-yl N-(1-oxo-1-phenylpropan-2-yl)carbamate
CID 139904871
2-(4-chloroanilino)-1-phenylpropan-1-one
CID 14026529
2-methyl-1,5-diphenylpentane-1,3,5-trione
CID 14303545
3-(methoxymethylamino)-2-methyl-1-phenylpropan-1-one
CID 119081869
2-(1-hydroxybutan-2-ylamino)-1-phenylpropan-1-one
CID 82100066
N-[2-[(1-oxo-1-phenylpropan-2-yl)amino]ethyl]acetamide
CID 82100041

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide?
The IUPAC name of N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide (CID 130699282) is N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide.
What is the SMILES notation for N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide?
The canonical SMILES for N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide is C[C@@H](NC=O)C(=O)c1ccccc1.
What is the InChIKey of N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide?
The InChIKey is OFKFNAQOHGEOIG-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-8(11-7-12)10(13)9-5-3-2-4-6-9/h2-8H,1H3,(H,11,12)/t8-/m1/s1.
What are the key properties of N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide?
N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide has a molecular weight of 177.20 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-oxo-1-phenylpropan-2-yl]formamide is sourced from PubChem (CID 130699282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).