N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide

C17H18N2O — CID 6470011

IUPACN-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCc3ccccc32)cc1C
InChIInChI=1S/C17H18N2O/c1-12-7-8-15(11-13(12)2)18-17(20)19-10-9-14-5-3-4-6-16(14)19/h3-8,11H,9-10H2,1-2H3,(H,18,20)
InChIKeyMLDSGYHSDRVLMW-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.90
Rot. Bonds1

About N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide

N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide (PubChem CID 6470011) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide
PubChem CID6470011
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCc3ccccc32)cc1C
InChIInChI=1S/C17H18N2O/c1-12-7-8-15(11-13(12)2)18-17(20)19-10-9-14-5-3-4-6-16(14)19/h3-8,11H,9-10H2,1-2H3,(H,18,20)
InChIKeyMLDSGYHSDRVLMW-UHFFFAOYSA-N
XLogP3.90
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-dihydroindol-1-yl)-N-(3,4-dimethylphenyl)-2-oxoacetamide
CID 108523162
N-(3,4-difluorophenyl)-2,3-dihydroindole-1-carboxamide
CID 108991230
N-(4-aminophenyl)-2,3-dihydroindole-1-carboxamide
CID 43469027
CID 144672697
CID 144672697
N-[3-methyl-4-(4-oxo-3H-phthalazin-1-yl)phenyl]-2,3-dihydroindole-1-carboxamide
CID 90284863
1-[2-(2,3-dihydroindol-1-yl)-2-oxo-1-phenylethyl]-3-(3,4-dimethylphenyl)urea
CID 46383540
N-(3,4-dimethylphenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide
CID 20907134
2,3-dihydroindol-1-yl-(3,4-dimethylphenyl)methanone
CID 669367
N-(3-hydroxy-4-methoxyphenyl)-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide
CID 69224339
N-(4-nitrophenyl)-2,3-dihydroindole-1-carboxamide
CID 2897905
4-(2,3-dihydroindole-1-carbonyl)-N-(3,4-dimethylphenyl)benzenesulfonamide
CID 43006039
N-(4-methyl-3-oxo-1,4-benzothiazin-6-yl)-2,3-dihydroindole-1-carboxamide
CID 3235768

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide (CID 6470011) is N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide is Cc1ccc(NC(=O)N2CCc3ccccc32)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide?
The InChIKey is MLDSGYHSDRVLMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-12-7-8-15(11-13(12)2)18-17(20)19-10-9-14-5-3-4-6-16(14)19/h3-8,11H,9-10H2,1-2H3,(H,18,20).
What are the key properties of N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide?
N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 3.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 6470011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).