1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide

C17H14Cl2N2O2 — CID 109043435

IUPAC1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C17H14Cl2N2O2/c18-12-5-8-15(14(19)9-12)21-17(23)11-3-1-10(2-4-11)16(22)20-13-6-7-13/h1-5,8-9,13H,6-7H2,(H,20,22)(H,21,23)
InChIKeyIVTGMQZZOMXLAE-UHFFFAOYSA-N
MW349.22 g/mol
LogP4.14
Rot. Bonds4

About 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide

1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide (PubChem CID 109043435) has the molecular formula C17H14Cl2N2O2 and a molecular weight of 349.22 g/mol. Its IUPAC name is 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide
PubChem CID109043435
Molecular FormulaC17H14Cl2N2O2
Molecular Weight349.22 g/mol
Exact Mass348.04
IUPAC Name1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C17H14Cl2N2O2/c18-12-5-8-15(14(19)9-12)21-17(23)11-3-1-10(2-4-11)16(22)20-13-6-7-13/h1-5,8-9,13H,6-7H2,(H,20,22)(H,21,23)
InChIKeyIVTGMQZZOMXLAE-UHFFFAOYSA-N
XLogP4.14
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.22
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide 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

1-N-cyclopentyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide
CID 109044538
N-cyclopropyl-N'-(2,4-dichlorophenyl)oxamide
CID 108502911
2-N-cyclohexyl-4-N-(2,4-dichlorophenyl)pyridine-2,4-dicarboxamide
CID 109081635
4-tert-butyl-N-(2,4-dichlorophenyl)benzamide
CID 773784
2,5-dichloro-N-[4-[(2,5-dichlorobenzoyl)amino]cyclohexyl]benzamide
CID 2165949
1-(2,4-dichlorophenyl)-3-(4-methylcyclohexyl)urea
CID 51421854
3-bromo-N-(2,4-dichlorophenyl)-4-methylbenzamide
CID 1297695
1-N-(5-chloro-2-methylphenyl)-3-N-cyclopropylbenzene-1,3-dicarboxamide
CID 109050783
N-cyclopropyl-2-(2,4-dichloroanilino)propanamide
CID 43085964
1-N-butyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide
CID 109043816
4-[(5-chloro-2-methylphenyl)carbamoylamino]-N-cyclopropylbenzamide
CID 17180530
N-(2,4-dichlorophenyl)-4-[(4-methylpiperidin-1-yl)methyl]benzamide
CID 92646467

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide?
The IUPAC name of 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide (CID 109043435) is 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide?
The canonical SMILES for 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide is O=C(Nc1ccc(Cl)cc1Cl)c1ccc(C(=O)NC2CC2)cc1.
What is the InChIKey of 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide?
The InChIKey is IVTGMQZZOMXLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N2O2/c18-12-5-8-15(14(19)9-12)21-17(23)11-3-1-10(2-4-11)16(22)20-13-6-7-13/h1-5,8-9,13H,6-7H2,(H,20,22)(H,21,23).
What are the key properties of 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide?
1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide has a molecular weight of 349.22 g/mol, XLogP of 4.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclopropyl-4-N-(2,4-dichlorophenyl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 109043435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).