1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine

C14H22N2 — CID 62415611

IUPAC1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
SMILESCC1(C)Cc2c(ccn2C2CCC2)C(N)C1
InChIInChI=1S/C14H22N2/c1-14(2)8-12(15)11-6-7-16(13(11)9-14)10-4-3-5-10/h6-7,10,12H,3-5,8-9,15H2,1-2H3
InChIKeyKMDLDFSRYPTBAT-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.19
Rot. Bonds1

About 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine

1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine (PubChem CID 62415611) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine.

Molecular Properties

Compound Name1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
PubChem CID62415611
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
SMILESCC1(C)Cc2c(ccn2C2CCC2)C(N)C1
InChIInChI=1S/C14H22N2/c1-14(2)8-12(15)11-6-7-16(13(11)9-14)10-4-3-5-10/h6-7,10,12H,3-5,8-9,15H2,1-2H3
InChIKeyKMDLDFSRYPTBAT-UHFFFAOYSA-N
XLogP3.19
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethylcyclohexyl)-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
CID 63466459
1-(3,5-dimethylcyclohexyl)-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
CID 64734465
1-(3,4-dimethylcyclohexyl)-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
CID 64743500
2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol
CID 55064325
1-(3-methoxycyclobutyl)-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
CID 114120203
1-cyclooctyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-ol
CID 63466233
6,6-dimethyl-1-(3-pyrrolidin-1-ylpropyl)-5,7-dihydro-4H-indol-4-amine
CID 62993220
1-(2,6-dimethylphenyl)-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
CID 63465018
1-[(4-ethylphenyl)methyl]-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine
CID 106900702
6,6-dimethyl-1-(3-methylbut-2-enyl)-5,7-dihydro-4H-indol-4-amine
CID 114155626
6,6-dimethyl-1-[(3-methylcyclopentyl)methyl]-5,7-dihydro-4H-indol-4-amine
CID 107415147
6,6-dimethyl-1-[2-(1-methylpiperidin-4-yl)ethyl]-5,7-dihydro-4H-indol-4-amine
CID 114516610

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine?
The IUPAC name of 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine (CID 62415611) is 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine.
What is the SMILES notation for 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine?
The canonical SMILES for 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine is CC1(C)Cc2c(ccn2C2CCC2)C(N)C1.
What is the InChIKey of 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine?
The InChIKey is KMDLDFSRYPTBAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-14(2)8-12(15)11-6-7-16(13(11)9-14)10-4-3-5-10/h6-7,10,12H,3-5,8-9,15H2,1-2H3.
What are the key properties of 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine?
1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine has a molecular weight of 218.34 g/mol, XLogP of 3.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-6,6-dimethyl-5,7-dihydro-4H-indol-4-amine is sourced from PubChem (CID 62415611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).