N-methoxy-2-phenylcyclopropane-1-carboxamide

C11H13NO2 — CID 72524749

IUPACN-methoxy-2-phenylcyclopropane-1-carboxamide
SMILESCONC(=O)C1CC1c1ccccc1
InChIInChI=1S/C11H13NO2/c1-14-12-11(13)10-7-9(10)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3,(H,12,13)
InChIKeyAGRBTMMNYDDYQH-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.47
Rot. Bonds3

About N-methoxy-2-phenylcyclopropane-1-carboxamide

N-methoxy-2-phenylcyclopropane-1-carboxamide (PubChem CID 72524749) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is N-methoxy-2-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-methoxy-2-phenylcyclopropane-1-carboxamide
PubChem CID72524749
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC NameN-methoxy-2-phenylcyclopropane-1-carboxamide
SMILESCONC(=O)C1CC1c1ccccc1
InChIInChI=1S/C11H13NO2/c1-14-12-11(13)10-7-9(10)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3,(H,12,13)
InChIKeyAGRBTMMNYDDYQH-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

trans-(1R,2R)-2-(3-bromophenyl)-N-methoxycyclopropane-1-carboxamide
CID 94813050
trans-methyl (1S,2S)-2-phenylcyclopropane-1-carboxylate
CID 642984
ethane;2-phenylcyclopropane-1-carboxylic acid
CID 91570346
cis-(1R,2S)-2-phenylcyclopropane-1-carboxylic acid
CID 778516
methyl 3-oxo-3-[(1R,2R)-2-phenylcyclopropyl]propanoate
CID 101155586
methyl 4-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]pentanoate
CID 78971251
cis-(1R,2S)-N-(4-acetamidophenyl)-2-phenylcyclopropane-1-carboxamide
CID 7071046
2,2-dimethoxy-1-(2-phenylcyclopropyl)ethanone
CID 116517110
trans-(1S,2S)-N-[(1S)-1-(2-methoxyphenyl)ethyl]-2-phenylcyclopropane-1-carboxamide
CID 72947289
N-[2-methoxy-4-[3-methoxy-4-[(2-phenylcyclopropanecarbonyl)amino]phenyl]phenyl]-2-phenylcyclopropane-1-carboxamide
CID 3698096
N-(3-amino-2-hydroxy-3-oxopropyl)-2-phenylcyclopropane-1-carboxamide
CID 107261035
N-(4-bromobutan-2-yl)-2-phenylcyclopropane-1-carboxamide
CID 83180682

Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-methoxy-2-phenylcyclopropane-1-carboxamide (CID 72524749) is N-methoxy-2-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-methoxy-2-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-methoxy-2-phenylcyclopropane-1-carboxamide is CONC(=O)C1CC1c1ccccc1.
What is the InChIKey of N-methoxy-2-phenylcyclopropane-1-carboxamide?
The InChIKey is AGRBTMMNYDDYQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-14-12-11(13)10-7-9(10)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3,(H,12,13).
What are the key properties of N-methoxy-2-phenylcyclopropane-1-carboxamide?
N-methoxy-2-phenylcyclopropane-1-carboxamide has a molecular weight of 191.23 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 72524749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).