N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide

C12H14N2O — CID 5420065

IUPACN-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide
SMILESC/C(=N/NC(=O)C1CC1)c1ccccc1
InChIInChI=1S/C12H14N2O/c1-9(10-5-3-2-4-6-10)13-14-12(15)11-7-8-11/h2-6,11H,7-8H2,1H3,(H,14,15)/b13-9-
InChIKeyJKTJUUUSDXXBIW-LCYFTJDESA-N
MW202.26 g/mol
LogP1.94
Rot. Bonds3

About N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide

N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide (PubChem CID 5420065) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide
PubChem CID5420065
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide
SMILESC/C(=N/NC(=O)C1CC1)c1ccccc1
InChIInChI=1S/C12H14N2O/c1-9(10-5-3-2-4-6-10)13-14-12(15)11-7-8-11/h2-6,11H,7-8H2,1H3,(H,14,15)/b13-9-
InChIKeyJKTJUUUSDXXBIW-LCYFTJDESA-N
XLogP1.94
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-1-(4-hydroxyphenyl)ethylideneamino]cyclopropanecarboxamide
CID 136690060
N-[(Z)-1-(4-fluorophenyl)ethylideneamino]cyclopropanecarboxamide
CID 6078923
N-[(Z)-1-(4-tert-butylphenyl)ethylideneamino]cyclopropanecarboxamide
CID 6019410
N-[1-(3-aminophenyl)ethylideneamino]cyclopropanecarboxamide
CID 922383
N-[1-(2-hydroxyphenyl)ethylideneamino]cyclopropanecarboxamide
CID 3541547
N-[(E)-1-(4-chlorophenyl)ethylideneamino]cyclopentanecarboxamide
CID 25237608
2-phenyl-N-(1-phenylethylideneamino)cyclopropane-1-carboxamide
CID 3097435
cis-(1R,2S)-2-phenyl-N-(1-phenylethylideneamino)cyclopropane-1-carboxamide
CID 129439028
N-[(Z)-1-(3,4-difluorophenyl)ethylideneamino]cyclopropanecarboxamide
CID 9234157
N-(1-naphthalen-2-ylethylideneamino)cyclohexanecarboxamide
CID 832851
N-[(E)-1-(3-hydroxyphenyl)ethylideneamino]cyclohexanecarboxamide
CID 19685369
5-[(Z)-N-(cyclopropanecarbonylamino)-C-methylcarbonimidoyl]thiophene-2-carboxylic acid
CID 8826199

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide?
The IUPAC name of N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide (CID 5420065) is N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide.
What is the SMILES notation for N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide?
The canonical SMILES for N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide is C/C(=N/NC(=O)C1CC1)c1ccccc1.
What is the InChIKey of N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide?
The InChIKey is JKTJUUUSDXXBIW-LCYFTJDESA-N. The full InChI is InChI=1S/C12H14N2O/c1-9(10-5-3-2-4-6-10)13-14-12(15)11-7-8-11/h2-6,11H,7-8H2,1H3,(H,14,15)/b13-9-.
What are the key properties of N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide?
N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide has a molecular weight of 202.26 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide is sourced from PubChem (CID 5420065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).