N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide

C14H18N2O — CID 113467223

IUPACN-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide
SMILESCC1CC(NC(=O)c2ccc3c(c2)NCC3)C1
InChIInChI=1S/C14H18N2O/c1-9-6-12(7-9)16-14(17)11-3-2-10-4-5-15-13(10)8-11/h2-3,8-9,12,15H,4-7H2,1H3,(H,16,17)
InChIKeyQVCSSKNGOXVSCJ-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.18
Rot. Bonds2

About N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide

N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide (PubChem CID 113467223) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide
PubChem CID113467223
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC NameN-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide
SMILESCC1CC(NC(=O)c2ccc3c(c2)NCC3)C1
InChIInChI=1S/C14H18N2O/c1-9-6-12(7-9)16-14(17)11-3-2-10-4-5-15-13(10)8-11/h2-3,8-9,12,15H,4-7H2,1H3,(H,16,17)
InChIKeyQVCSSKNGOXVSCJ-UHFFFAOYSA-N
XLogP2.18
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2,3-dihydro-1H-indole-6-carboxamide
CID 113382512
N-cyclopropyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142413
N-(3-methylcyclobutyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103720343
N-(4-ethylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61470340
3-[(3-methylcyclobutyl)carbamoyl]benzoic acid
CID 115910449
3-bromo-4-chloro-N-(3-methylcyclobutyl)benzamide
CID 103842108
N-(3-benzamidophenyl)-2,3-dihydro-1H-indole-6-carboxamide
CID 143229213
N-(oxolan-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
CID 80712536
N-(2-methoxy-2-methylpropyl)-2,3-dihydro-1H-indole-6-carboxamide
CID 104761349
4-cyano-N-(3,5-dimethylcyclohexyl)benzamide
CID 64724364
4-amino-3-chloro-N-(3,5-dimethylcyclohexyl)benzamide
CID 64733696
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-2,3-dihydro-1H-indole-6-carboxamide
CID 106276798

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide?
The IUPAC name of N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide (CID 113467223) is N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide.
What is the SMILES notation for N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide?
The canonical SMILES for N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide is CC1CC(NC(=O)c2ccc3c(c2)NCC3)C1.
What is the InChIKey of N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide?
The InChIKey is QVCSSKNGOXVSCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-9-6-12(7-9)16-14(17)11-3-2-10-4-5-15-13(10)8-11/h2-3,8-9,12,15H,4-7H2,1H3,(H,16,17).
What are the key properties of N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide?
N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide has a molecular weight of 230.31 g/mol, XLogP of 2.18, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclobutyl)-2,3-dihydro-1H-indole-6-carboxamide is sourced from PubChem (CID 113467223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).