N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide

C11H10Cl2N2O — CID 5420026

IUPACN-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide
SMILESO=C(N/N=C\c1c(Cl)cccc1Cl)C1CC1
InChIInChI=1S/C11H10Cl2N2O/c12-9-2-1-3-10(13)8(9)6-14-15-11(16)7-4-5-7/h1-3,6-7H,4-5H2,(H,15,16)/b14-6-
InChIKeyVFOBPXPSEGTJBH-NSIKDUERSA-N
MW257.12 g/mol
LogP2.85
Rot. Bonds3

About N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide

N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide (PubChem CID 5420026) has the molecular formula C11H10Cl2N2O and a molecular weight of 257.12 g/mol. Its IUPAC name is N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide
PubChem CID5420026
Molecular FormulaC11H10Cl2N2O
Molecular Weight257.12 g/mol
Exact Mass256.02
IUPAC NameN-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide
SMILESO=C(N/N=C\c1c(Cl)cccc1Cl)C1CC1
InChIInChI=1S/C11H10Cl2N2O/c12-9-2-1-3-10(13)8(9)6-14-15-11(16)7-4-5-7/h1-3,6-7H,4-5H2,(H,15,16)/b14-6-
InChIKeyVFOBPXPSEGTJBH-NSIKDUERSA-N
XLogP2.85
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.12
LogP ≤ 52.85
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-[(2,6-dichlorophenyl)methylideneamino]bicyclo[4.1.0]heptane-7-carboxamide
CID 5038735
N-[(E)-(2-chlorophenyl)methylideneamino]cyclopropanecarboxamide
CID 5334576
N-[(Z)-(10-chloroanthracen-9-yl)methylideneamino]cyclopropanecarboxamide
CID 9234678
1-(4-chlorobenzoyl)-N-[(Z)-(2,6-dichlorophenyl)methylideneamino]piperidine-4-carboxamide
CID 126011043
N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 126012282
cis-(1S,2R)-N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-2-phenylcyclopropane-1-carboxamide
CID 7452524
N-[(2,3-dihydroxyphenyl)methylideneamino]cyclopropanecarboxamide
CID 2693831
N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-2-oxo-4-phenylpyrrolidine-3-carboxamide
CID 6159848
N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]cyclopropanecarboxamide
CID 6910562
1-N,4-N-bis[(Z)-(2-hydroxyphenyl)methylideneamino]cyclohexane-1,4-dicarboxamide
CID 135977022
N-[(E)-(2,6-dichlorophenyl)methylideneamino]-2-methylpropanamide
CID 14593053
(3R)-1-(4-bromophenyl)-N-[(Z)-(2,6-dichlorophenyl)methylideneamino]-5-oxopyrrolidine-3-carboxamide
CID 126273303

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide?
The IUPAC name of N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide (CID 5420026) is N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide.
What is the SMILES notation for N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide?
The canonical SMILES for N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide is O=C(N/N=C\c1c(Cl)cccc1Cl)C1CC1.
What is the InChIKey of N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide?
The InChIKey is VFOBPXPSEGTJBH-NSIKDUERSA-N. The full InChI is InChI=1S/C11H10Cl2N2O/c12-9-2-1-3-10(13)8(9)6-14-15-11(16)7-4-5-7/h1-3,6-7H,4-5H2,(H,15,16)/b14-6-.
What are the key properties of N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide?
N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide has a molecular weight of 257.12 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,6-dichlorophenyl)methylideneamino]cyclopropanecarboxamide is sourced from PubChem (CID 5420026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).