1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine

C17H24N2 — CID 62407326

IUPAC1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine
SMILESCC(NCc1c[nH]c2ccccc12)C1CCCCC1
InChIInChI=1S/C17H24N2/c1-13(14-7-3-2-4-8-14)18-11-15-12-19-17-10-6-5-9-16(15)17/h5-6,9-10,12-14,18-19H,2-4,7-8,11H2,1H3
InChIKeyNCIALMJVRXRQAO-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.23
Rot. Bonds4

About 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine

1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine (PubChem CID 62407326) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine
PubChem CID62407326
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine
SMILESCC(NCc1c[nH]c2ccccc12)C1CCCCC1
InChIInChI=1S/C17H24N2/c1-13(14-7-3-2-4-8-14)18-11-15-12-19-17-10-6-5-9-16(15)17/h5-6,9-10,12-14,18-19H,2-4,7-8,11H2,1H3
InChIKeyNCIALMJVRXRQAO-UHFFFAOYSA-N
XLogP4.23
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-N-(naphthalen-1-ylmethyl)ethanamine
CID 63477824
(2R)-2-(1H-indol-3-ylmethylamino)propan-1-ol
CID 114985544
(2R)-N-(1H-indol-3-ylmethyl)butan-2-amine
CID 92864086
N-[(2-bromophenyl)methyl]-1-cyclohexylethanamine
CID 63453704
(1S)-1-cyclohexyl-N-[(1-methylindol-3-yl)methyl]ethanamine
CID 107235981
2-(1H-indol-3-ylmethylamino)propanenitrile
CID 115130152
2-(1H-indol-3-ylmethylamino)-N-methylpropanamide
CID 61057745
1-[[[(1R)-1-cyclohexylethyl]amino]methyl]naphthalen-2-ol
CID 81388297
N-(1-cyclohexylethyl)-1H-indole-3-carboxamide
CID 62405126
N-[(2-bromophenyl)methyl]-1-cyclopentylethanamine
CID 62632119
(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine
CID 81394013
N-[(2R)-1-(1H-indol-3-yl)propan-2-yl]cyclopropanamine
CID 95732551

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine?
The IUPAC name of 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine (CID 62407326) is 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine.
What is the SMILES notation for 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine?
The canonical SMILES for 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine is CC(NCc1c[nH]c2ccccc12)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine?
The InChIKey is NCIALMJVRXRQAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-13(14-7-3-2-4-8-14)18-11-15-12-19-17-10-6-5-9-16(15)17/h5-6,9-10,12-14,18-19H,2-4,7-8,11H2,1H3.
What are the key properties of 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine?
1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine has a molecular weight of 256.39 g/mol, XLogP of 4.23, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(1H-indol-3-ylmethyl)ethanamine is sourced from PubChem (CID 62407326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).