N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide

C20H17N3O — CID 53050227

IUPACN-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc3ccc4cccnc4c3[nH]2)c1C
InChIInChI=1S/C20H17N3O/c1-12-5-3-7-16(13(12)2)23-20(24)17-11-15-9-8-14-6-4-10-21-18(14)19(15)22-17/h3-11,22H,1-2H3,(H,23,24)
InChIKeyLDIZMHBUQRPXON-UHFFFAOYSA-N
MW315.38 g/mol
LogP4.59
Rot. Bonds2

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

N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide (PubChem CID 53050227) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
PubChem CID53050227
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC NameN-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc3ccc4cccnc4c3[nH]2)c1C
InChIInChI=1S/C20H17N3O/c1-12-5-3-7-16(13(12)2)23-20(24)17-11-15-9-8-14-6-4-10-21-18(14)19(15)22-17/h3-11,22H,1-2H3,(H,23,24)
InChIKeyLDIZMHBUQRPXON-UHFFFAOYSA-N
XLogP4.59
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chloro-4-methylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
CID 20925592
N-(2,3-dimethylphenyl)quinoline-8-carboxamide
CID 30267815
N-cyclopropyl-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
CID 53003807
7-chloro-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 108804025
7-amino-N-(3-methyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 63117500
N-(3-chloro-4-methoxyphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
CID 20925522
N-[2-(2,3-dimethylanilino)-2-oxoethyl]quinoline-8-carboxamide
CID 24681832
N-(2,3-dimethylphenyl)-2-quinolin-8-yloxyacetamide
CID 94221258
5-amino-N-(2-methyl-3-pyridinyl)-1H-indole-2-carboxamide
CID 79041889
N-[2-(4-methylpiperazin-1-yl)ethyl]-1H-pyrrolo[3,2-h]quinoline-2-carboxamide
CID 20925636
5-methyl-N-quinolin-8-ylthiophene-3-carboxamide
CID 166451949
N-(2-chloro-6-methylphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 141390702

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide (CID 53050227) is N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide is Cc1cccc(NC(=O)c2cc3ccc4cccnc4c3[nH]2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
The InChIKey is LDIZMHBUQRPXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O/c1-12-5-3-7-16(13(12)2)23-20(24)17-11-15-9-8-14-6-4-10-21-18(14)19(15)22-17/h3-11,22H,1-2H3,(H,23,24).
What are the key properties of N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide?
N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide has a molecular weight of 315.38 g/mol, XLogP of 4.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-1H-pyrrolo[3,2-h]quinoline-2-carboxamide is sourced from PubChem (CID 53050227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).