N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide

C14H16Cl2N2O — CID 25237610

IUPACN-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide
SMILESC/C(=N\NC(=O)C1CCCC1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H16Cl2N2O/c1-9(12-7-6-11(15)8-13(12)16)17-18-14(19)10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,18,19)/b17-9+
InChIKeyKKKISRSRTIOPGM-RQZCQDPDSA-N
MW299.20 g/mol
LogP4.02
Rot. Bonds3

About N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide

N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide (PubChem CID 25237610) has the molecular formula C14H16Cl2N2O and a molecular weight of 299.20 g/mol. Its IUPAC name is N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide
PubChem CID25237610
Molecular FormulaC14H16Cl2N2O
Molecular Weight299.20 g/mol
Exact Mass298.06
IUPAC NameN-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide
SMILESC/C(=N\NC(=O)C1CCCC1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C14H16Cl2N2O/c1-9(12-7-6-11(15)8-13(12)16)17-18-14(19)10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,18,19)/b17-9+
InChIKeyKKKISRSRTIOPGM-RQZCQDPDSA-N
XLogP4.02
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.20
LogP ≤ 54.02
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'}

Analyze N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(E)-1-(4-chlorophenyl)ethylideneamino]cyclopentanecarboxamide
CID 25237608
N-[(Z)-1-(2,4-dichlorophenyl)propylideneamino]cyclopropanecarboxamide
CID 6300945
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]cyclohexanecarboxamide
CID 5161964
N-[1-(2,4-dichlorophenyl)ethylideneamino]-2,4-dihydroxybenzamide
CID 3626855
4-amino-N-[(Z)-1-(2,4-dichlorophenyl)ethylideneamino]benzamide
CID 7955460
N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]pyridine-4-carboxamide
CID 6941499
cyclobutyl-(2,4-dichlorophenyl)methanone
CID 24724148
(3R)-N-[(E)-1-(5-chloro-2-hydroxyphenyl)ethylideneamino]-1,1-dioxothiolane-3-carboxamide
CID 135817842
2,4-dichloro-N-[1-(4-chlorophenyl)ethylideneamino]benzamide
CID 904479
N-[[4-(4-chloro-2-methylanilino)-4-oxobutan-2-ylidene]amino]cyclohexanecarboxamide
CID 3497267
N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]-2-methylfuran-3-carboxamide
CID 7289797
N-[(Z)-1-(2,4-dichlorophenyl)ethylideneamino]pyridine-2-carboxamide
CID 5402845

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide?
The IUPAC name of N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide (CID 25237610) is N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide.
What is the SMILES notation for N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide?
The canonical SMILES for N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide is C/C(=N\NC(=O)C1CCCC1)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide?
The InChIKey is KKKISRSRTIOPGM-RQZCQDPDSA-N. The full InChI is InChI=1S/C14H16Cl2N2O/c1-9(12-7-6-11(15)8-13(12)16)17-18-14(19)10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,18,19)/b17-9+.
What are the key properties of N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide?
N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide has a molecular weight of 299.20 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(2,4-dichlorophenyl)ethylideneamino]cyclopentanecarboxamide is sourced from PubChem (CID 25237610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).