N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide

C15H12Cl2N2O2 — CID 9234874

IUPACN-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide
SMILESO=C(N/N=C\c1ccc(-c2cc(Cl)ccc2Cl)o1)C1CC1
InChIInChI=1S/C15H12Cl2N2O2/c16-10-3-5-13(17)12(7-10)14-6-4-11(21-14)8-18-19-15(20)9-1-2-9/h3-9H,1-2H2,(H,19,20)/b18-8-
InChIKeyAHTUMRJXIDCNPS-LSCVHKIXSA-N
MW323.18 g/mol
LogP4.11
Rot. Bonds4

About N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide

N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide (PubChem CID 9234874) has the molecular formula C15H12Cl2N2O2 and a molecular weight of 323.18 g/mol. Its IUPAC name is N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide
PubChem CID9234874
Molecular FormulaC15H12Cl2N2O2
Molecular Weight323.18 g/mol
Exact Mass322.03
IUPAC NameN-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide
SMILESO=C(N/N=C\c1ccc(-c2cc(Cl)ccc2Cl)o1)C1CC1
InChIInChI=1S/C15H12Cl2N2O2/c16-10-3-5-13(17)12(7-10)14-6-4-11(21-14)8-18-19-15(20)9-1-2-9/h3-9H,1-2H2,(H,19,20)/b18-8-
InChIKeyAHTUMRJXIDCNPS-LSCVHKIXSA-N
XLogP4.11
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.18
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-[[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]pyridine-4-carboxamide
CID 616953
N-[[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-6-methylpyridine-3-carboxamide
CID 1390262
N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-1,3-benzodioxole-5-carboxamide
CID 6218347
N-[(Z)-[5-(2-fluorophenyl)furan-2-yl]methylideneamino]cyclohexanecarboxamide
CID 9150506
1-[[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-3-(1,1-dioxothiolan-3-yl)thiourea
CID 2852545
2-(4-bromoanilino)-N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]acetamide
CID 126356740
5-bromo-N-[(E)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-2-hydroxybenzamide
CID 21370754
N-[(E)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-2-naphthalen-1-ylacetamide
CID 6321807
2-(3-chlorophenoxy)-N-[[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]acetamide
CID 71952295
N-[(5-methylfuran-2-yl)methylideneamino]cyclopropanecarboxamide
CID 871912
1-[[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]-3-phenylthiourea
CID 3104270
[(Z)-[5-(2-chlorophenyl)furan-2-yl]methylideneamino]urea
CID 5412189

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide?
The IUPAC name of N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide (CID 9234874) is N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide.
What is the SMILES notation for N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide?
The canonical SMILES for N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide is O=C(N/N=C\c1ccc(-c2cc(Cl)ccc2Cl)o1)C1CC1.
What is the InChIKey of N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide?
The InChIKey is AHTUMRJXIDCNPS-LSCVHKIXSA-N. The full InChI is InChI=1S/C15H12Cl2N2O2/c16-10-3-5-13(17)12(7-10)14-6-4-11(21-14)8-18-19-15(20)9-1-2-9/h3-9H,1-2H2,(H,19,20)/b18-8-.
What are the key properties of N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide?
N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide has a molecular weight of 323.18 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-[5-(2,5-dichlorophenyl)furan-2-yl]methylideneamino]cyclopropanecarboxamide is sourced from PubChem (CID 9234874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).