1-(1-cyclohexylindol-5-yl)propan-2-amine

C17H24N2 — CID 117118608

IUPAC1-(1-cyclohexylindol-5-yl)propan-2-amine
SMILESCC(N)Cc1ccc2c(ccn2C2CCCCC2)c1
InChIInChI=1S/C17H24N2/c1-13(18)11-14-7-8-17-15(12-14)9-10-19(17)16-5-3-2-4-6-16/h7-10,12-13,16H,2-6,11,18H2,1H3
InChIKeyTZCVTXCEMPNVJE-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.04
Rot. Bonds3

About 1-(1-cyclohexylindol-5-yl)propan-2-amine

1-(1-cyclohexylindol-5-yl)propan-2-amine (PubChem CID 117118608) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-(1-cyclohexylindol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1-cyclohexylindol-5-yl)propan-2-amine
PubChem CID117118608
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name1-(1-cyclohexylindol-5-yl)propan-2-amine
SMILESCC(N)Cc1ccc2c(ccn2C2CCCCC2)c1
InChIInChI=1S/C17H24N2/c1-13(18)11-14-7-8-17-15(12-14)9-10-19(17)16-5-3-2-4-6-16/h7-10,12-13,16H,2-6,11,18H2,1H3
InChIKeyTZCVTXCEMPNVJE-UHFFFAOYSA-N
XLogP4.04
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-cyclopentylindol-5-yl)-2-methylpropan-2-ol
CID 115115482
2-(1-cyclohexylindol-5-yl)propanoic acid
CID 117118613
3-(1-cyclopentylindol-6-yl)-2-methylpropanoic acid
CID 115115521
1-[1-(3-methylbutyl)indol-5-yl]propan-2-amine
CID 102917538
1-[1-(cyclobutylmethyl)indol-6-yl]propan-2-amine
CID 115106688
1-(1-cyclopentylindol-5-yl)ethanone
CID 115115492
1-(1-pentylindol-5-yl)propan-2-amine
CID 102917546
1-cyclopentylindole-5-carbaldehyde
CID 115115491
1-[1-(2-ethylsulfonylethyl)indol-5-yl]propan-2-amine
CID 102917550
1-[1-(cyclopentylmethyl)indol-5-yl]propan-2-ol
CID 115106762
3-(1-cyclopropylindol-5-yl)propanoic acid
CID 155919864
2-[1-(1-methylpiperidin-4-yl)indol-5-yl]ethanesulfonamide
CID 70383161

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylindol-5-yl)propan-2-amine?
The IUPAC name of 1-(1-cyclohexylindol-5-yl)propan-2-amine (CID 117118608) is 1-(1-cyclohexylindol-5-yl)propan-2-amine.
What is the SMILES notation for 1-(1-cyclohexylindol-5-yl)propan-2-amine?
The canonical SMILES for 1-(1-cyclohexylindol-5-yl)propan-2-amine is CC(N)Cc1ccc2c(ccn2C2CCCCC2)c1.
What is the InChIKey of 1-(1-cyclohexylindol-5-yl)propan-2-amine?
The InChIKey is TZCVTXCEMPNVJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-13(18)11-14-7-8-17-15(12-14)9-10-19(17)16-5-3-2-4-6-16/h7-10,12-13,16H,2-6,11,18H2,1H3.
What are the key properties of 1-(1-cyclohexylindol-5-yl)propan-2-amine?
1-(1-cyclohexylindol-5-yl)propan-2-amine has a molecular weight of 256.39 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylindol-5-yl)propan-2-amine is sourced from PubChem (CID 117118608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).