2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol

C16H26N2O — CID 55064325

IUPAC2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol
SMILESCC1(C)Cc2c(ccn2C2CCCCC2O)C(N)C1
InChIInChI=1S/C16H26N2O/c1-16(2)9-12(17)11-7-8-18(14(11)10-16)13-5-3-4-6-15(13)19/h7-8,12-13,15,19H,3-6,9-10,17H2,1-2H3
InChIKeyAXOSMSCVYCOGOJ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.94
Rot. Bonds1

About 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol

2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol (PubChem CID 55064325) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol
PubChem CID55064325
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol
SMILESCC1(C)Cc2c(ccn2C2CCCCC2O)C(N)C1
InChIInChI=1S/C16H26N2O/c1-16(2)9-12(17)11-7-8-18(14(11)10-16)13-5-3-4-6-15(13)19/h7-8,12-13,15,19H,3-6,9-10,17H2,1-2H3
InChIKeyAXOSMSCVYCOGOJ-UHFFFAOYSA-N
XLogP2.94
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol with MolForge

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Related Compounds

Indole, 14
CID 44473055
(1S,2R)-1-(3-fluorophenyl)-1-(3-methyl-1H-indol-1-yl)-3-(methylamino)propan-2-ol
CID 44626374
(1S,2R)-1-(1H-indol-1-yl)-3-(methylamino)-1-phenylpropan-2-ol
CID 45267665
(1S,2R)-1-(3-fluorophenyl)-1-(7-methyl-1H-indol-1-yl)-3-(methylamino)propan-2-ol
CID 45483079
(1S,2R)-1-(4-fluoro-1H-indol-1-yl)-1-(3-fluorophenyl)-3-(methylamino)propan-2-ol
CID 45483080
(1S,2R)-1-(5-fluoro-1H-indol-1-yl)-1-(3-fluorophenyl)-3-(methylamino)propan-2-ol
CID 45483084
(1S,2R)-1-(2-fluorophenyl)-1-(1H-indol-1-yl)-3-(methylamino)propan-2-ol
CID 45483088
(1S,2R)-1-(6-fluoro-1H-indol-1-yl)-1-(3-fluorophenyl)-3-(methylamino)propan-2-ol
CID 45483089
(1S,2R)-1-(3-ethyl-1H-indol-1-yl)-1-(3-fluorophenyl)-3-(methylamino)propan-2-ol
CID 45483094
(1S,2R)-1-(3-fluorophenyl)-1-(1H-indol-1-yl)-3-(methylamino)propan-2-ol
CID 45483095
(1S,2R)-1-(4-fluorophenyl)-1-(1H-indol-1-yl)-3-(methylamino)propan-2-ol
CID 45483096
(1S,2R)-1-(1H-indol-1-yl)-3-(methylamino)-1-o-tolylpropan-2-ol
CID 45483097

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol?
The IUPAC name of 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol (CID 55064325) is 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol?
The canonical SMILES for 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol is CC1(C)Cc2c(ccn2C2CCCCC2O)C(N)C1.
What is the InChIKey of 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol?
The InChIKey is AXOSMSCVYCOGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-16(2)9-12(17)11-7-8-18(14(11)10-16)13-5-3-4-6-15(13)19/h7-8,12-13,15,19H,3-6,9-10,17H2,1-2H3.
What are the key properties of 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol?
2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol has a molecular weight of 262.40 g/mol, XLogP of 2.94, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6,6-dimethyl-5,7-dihydro-4H-indol-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 55064325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).