N-methoxy-N-phenylprop-2-enamide

C10H11NO2 — CID 11816178

IUPACN-methoxy-N-phenylprop-2-enamide
SMILESC=CC(=O)N(OC)c1ccccc1
InChIInChI=1S/C10H11NO2/c1-3-10(12)11(13-2)9-7-5-4-6-8-9/h3-8H,1H2,2H3
InChIKeyHKLOQGLGDQJDQP-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.77
Rot. Bonds3

About N-methoxy-N-phenylprop-2-enamide

N-methoxy-N-phenylprop-2-enamide (PubChem CID 11816178) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is N-methoxy-N-phenylprop-2-enamide.

Molecular Properties

Compound NameN-methoxy-N-phenylprop-2-enamide
PubChem CID11816178
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC NameN-methoxy-N-phenylprop-2-enamide
SMILESC=CC(=O)N(OC)c1ccccc1
InChIInChI=1S/C10H11NO2/c1-3-10(12)11(13-2)9-7-5-4-6-8-9/h3-8H,1H2,2H3
InChIKeyHKLOQGLGDQJDQP-UHFFFAOYSA-N
XLogP1.77
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,3-dimethoxy-1,3-diphenylurea
CID 141165239
1-methoxy-1-phenylurea
CID 15620442
N-hydroxy-N-phenylprop-2-enamide
CID 11367183
methyl 2-[(N-prop-2-enoylanilino)methyl]prop-2-enoate
CID 101024124
N-benzyl-N-methoxyprop-2-enamide
CID 86239438
N-phenyl-N-prop-1-enylprop-2-enamide
CID 175394581
N-butyl-N-phenylprop-2-enamide
CID 43619884
N-(2-methoxyphenyl)sulfonyl-N-phenylprop-2-enamide
CID 89239390
2,2,2-trichloroethyl N-methoxy-N-phenylcarbamate
CID 132518639
(E)-4-(N,4-dimethoxyanilino)-4-oxobut-2-enoic acid
CID 172975186
N-(2-methylbutan-2-yl)-N-phenylprop-2-enamide
CID 139520013
methyl (2E)-2-[ethenyl(phenyl)hydrazinylidene]propanoate
CID 143469941

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-phenylprop-2-enamide?
The IUPAC name of N-methoxy-N-phenylprop-2-enamide (CID 11816178) is N-methoxy-N-phenylprop-2-enamide.
What is the SMILES notation for N-methoxy-N-phenylprop-2-enamide?
The canonical SMILES for N-methoxy-N-phenylprop-2-enamide is C=CC(=O)N(OC)c1ccccc1.
What is the InChIKey of N-methoxy-N-phenylprop-2-enamide?
The InChIKey is HKLOQGLGDQJDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-3-10(12)11(13-2)9-7-5-4-6-8-9/h3-8H,1H2,2H3.
What are the key properties of N-methoxy-N-phenylprop-2-enamide?
N-methoxy-N-phenylprop-2-enamide has a molecular weight of 177.20 g/mol, XLogP of 1.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-phenylprop-2-enamide is sourced from PubChem (CID 11816178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).