N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide

C19H14ClN3O — CID 20925592

IUPACN-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3ccc4cccnc4c3[nH]2)c(Cl)c1
InChIInChI=1S/C19H14ClN3O/c1-11-4-7-15(14(20)9-11)23-19(24)16-10-13-6-5-12-3-2-8-21-17(12)18(13)22-16/h2-10,22H,1H3,(H,23,24)
InChIKeyUKYFGUMGQCKJKK-UHFFFAOYSA-N
MW335.79 g/mol
LogP4.93
Rot. Bonds2

About N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide

N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide (PubChem CID 20925592) has the molecular formula C19H14ClN3O and a molecular weight of 335.79 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
PubChem CID20925592
Molecular FormulaC19H14ClN3O
Molecular Weight335.79 g/mol
Exact Mass335.08
IUPAC NameN-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
SMILESCc1ccc(NC(=O)c2cc3ccc4cccnc4c3[nH]2)c(Cl)c1
InChIInChI=1S/C19H14ClN3O/c1-11-4-7-15(14(20)9-11)23-19(24)16-10-13-6-5-12-3-2-8-21-17(12)18(13)22-16/h2-10,22H,1H3,(H,23,24)
InChIKeyUKYFGUMGQCKJKK-UHFFFAOYSA-N
XLogP4.93
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.79
LogP ≤ 54.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
The IUPAC name of N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide (CID 20925592) is N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide.
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide is Cc1ccc(NC(=O)c2cc3ccc4cccnc4c3[nH]2)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
The InChIKey is UKYFGUMGQCKJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O/c1-11-4-7-15(14(20)9-11)23-19(24)16-10-13-6-5-12-3-2-8-21-17(12)18(13)22-16/h2-10,22H,1H3,(H,23,24).
What are the key properties of N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide has a molecular weight of 335.79 g/mol, XLogP of 4.93, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide is sourced from PubChem (CID 20925592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).