N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide

C21H20N2O — CID 9047175

IUPACN-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide
SMILESCc1nc2ccccc2c(C)c1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C21H20N2O/c1-13-18-8-3-4-9-19(18)22-14(2)20(13)21(24)23-17-11-10-15-6-5-7-16(15)12-17/h3-4,8-12H,5-7H2,1-2H3,(H,23,24)
InChIKeyRCMJCUFMOZNCNT-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.59
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide

N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide (PubChem CID 9047175) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide
PubChem CID9047175
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide
SMILESCc1nc2ccccc2c(C)c1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C21H20N2O/c1-13-18-8-3-4-9-19(18)22-14(2)20(13)21(24)23-17-11-10-15-6-5-7-16(15)12-17/h3-4,8-12H,5-7H2,1-2H3,(H,23,24)
InChIKeyRCMJCUFMOZNCNT-UHFFFAOYSA-N
XLogP4.59
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide 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

2,4-dimethylquinoline-3-carbohydrazide
CID 3811999
2,4-dimethyl-N-[2-(trifluoromethyl)phenyl]quinoline-3-carboxamide
CID 8966624
N-(2,3-dihydro-1H-inden-5-yl)-2-(3-ethoxyphenyl)quinoline-4-carboxamide
CID 1018989
N-(2,3-dihydro-1H-inden-5-yl)-4-methylthiadiazole-5-carboxamide
CID 9087191
N-(4-acetamidophenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)quinoline-4-carboxamide
CID 2977359
N-(3,4-difluorophenyl)-2-methyl-4-phenylquinoline-3-carboxamide;hydrochloride
CID 42914787
N-(1,3-benzodioxol-5-yl)-2-ethyl-4-methylquinoline-3-carboxamide
CID 9191613
N-(4-acetamidophenyl)-2-ethyl-4-methylquinoline-3-carboxamide
CID 9191497
methyl 5-(2,3-dihydro-1H-inden-5-ylcarbamoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
CID 42464803
2-bromo-N-(2,3-dihydro-1H-inden-5-yl)benzamide
CID 2673412
N-(2,3-dihydro-1H-inden-5-yl)-2-[3-(2,3-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
CID 16531360
3-methyl-N-[3-[(3-methyl-2-phenylquinoline-4-carbonyl)amino]phenyl]-2-phenylquinoline-4-carboxamide
CID 3540473

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide (CID 9047175) is N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide is Cc1nc2ccccc2c(C)c1C(=O)Nc1ccc2c(c1)CCC2.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide?
The InChIKey is RCMJCUFMOZNCNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O/c1-13-18-8-3-4-9-19(18)22-14(2)20(13)21(24)23-17-11-10-15-6-5-7-16(15)12-17/h3-4,8-12H,5-7H2,1-2H3,(H,23,24).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide?
N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide has a molecular weight of 316.40 g/mol, XLogP of 4.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-2,4-dimethylquinoline-3-carboxamide is sourced from PubChem (CID 9047175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).