N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine

C16H23N — CID 113348472

IUPACN-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc2c(c1)C(NC(C)C1CCC1)CC2
InChIInChI=1S/C16H23N/c1-11-6-7-14-8-9-16(15(14)10-11)17-12(2)13-4-3-5-13/h6-7,10,12-13,16-17H,3-5,8-9H2,1-2H3
InChIKeyZBURWCVBETYMSK-UHFFFAOYSA-N
MW229.37 g/mol
LogP3.76
Rot. Bonds3

About N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine

N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 113348472) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID113348472
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC NameN-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1ccc2c(c1)C(NC(C)C1CCC1)CC2
InChIInChI=1S/C16H23N/c1-11-6-7-14-8-9-16(15(14)10-11)17-12(2)13-4-3-5-13/h6-7,10,12-13,16-17H,3-5,8-9H2,1-2H3
InChIKeyZBURWCVBETYMSK-UHFFFAOYSA-N
XLogP3.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-cyclobutylethyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 113349188
6-methyl-N-(3-methylbutan-2-yl)-2,3-dihydro-1H-inden-1-amine
CID 81300726
N-cyclopropyl-2-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]propanamide
CID 112696340
N-cyclopropyl-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 75488646
2-methyl-3-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 113262002
3-methyl-2-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]butanamide
CID 114176206
6-methyl-N-(1-pyridin-4-ylethyl)-2,3-dihydro-1H-inden-1-amine
CID 79040850
1-N,1-N,3-trimethyl-2-N-(6-methyl-2,3-dihydro-1H-inden-1-yl)butane-1,2-diamine
CID 81327422
N-[1-(2,6-difluorophenyl)ethyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 78956223
2-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]-1-piperidin-1-ylpropan-1-one
CID 81319484
1-(1-cyclohexylethylamino)-2,3-dihydro-1H-inden-5-ol
CID 107682320
N-[1-(3,4-difluorophenyl)ethyl]-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 78956222

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine (CID 113348472) is N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine is Cc1ccc2c(c1)C(NC(C)C1CCC1)CC2.
What is the InChIKey of N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is ZBURWCVBETYMSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-11-6-7-14-8-9-16(15(14)10-11)17-12(2)13-4-3-5-13/h6-7,10,12-13,16-17H,3-5,8-9H2,1-2H3.
What are the key properties of N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine?
N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 229.37 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 113348472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).