[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol

C17H24N2O — CID 110244912

IUPAC[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol
SMILESCCc1cccc2c(CN3CCCC(CO)C3)c[nH]c12
InChIInChI=1S/C17H24N2O/c1-2-14-6-3-7-16-15(9-18-17(14)16)11-19-8-4-5-13(10-19)12-20/h3,6-7,9,13,18,20H,2,4-5,8,10-12H2,1H3
InChIKeyKGHFZYKFYRVWKD-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.93
Rot. Bonds4

About [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol

[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol (PubChem CID 110244912) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol
PubChem CID110244912
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol
SMILESCCc1cccc2c(CN3CCCC(CO)C3)c[nH]c12
InChIInChI=1S/C17H24N2O/c1-2-14-6-3-7-16-15(9-18-17(14)16)11-19-8-4-5-13(10-19)12-20/h3,6-7,9,13,18,20H,2,4-5,8,10-12H2,1H3
InChIKeyKGHFZYKFYRVWKD-UHFFFAOYSA-N
XLogP2.93
TPSA39.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol with MolForge

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Related Compounds

1-[(7-ethyl-1H-indol-3-yl)methyl]pyrrolidin-3-amine
CID 55030032
[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol
CID 43817859
1-[(7-ethyl-1H-indol-3-yl)methyl]azetidine-3-carboxylic acid
CID 65071937
[(3S)-1-[(2-bromophenyl)methyl]piperidin-3-yl]methanol
CID 40514210
methyl 2-[[3-(hydroxymethyl)piperidin-1-yl]methyl]benzoate
CID 82969171
1-(7-ethyl-1H-indol-3-yl)-2-[(3S)-3-methylpiperidin-1-yl]ethanone
CID 9275355
[3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine
CID 84692922
4-[[3-(2-hydroxypropan-2-yl)piperidin-1-yl]methyl]-2H-isoquinolin-1-one
CID 166265372
2-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]benzonitrile
CID 86311278
2-[2-[[3-(hydroxymethyl)piperidin-1-yl]methyl]phenyl]acetohydrazide
CID 115465290
N-[[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methyl]propan-2-amine
CID 63240913
[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-3-yl]methanol
CID 95857188

Frequently Asked Questions

What is the IUPAC name of [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol?
The IUPAC name of [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol (CID 110244912) is [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol.
What is the SMILES notation for [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol?
The canonical SMILES for [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol is CCc1cccc2c(CN3CCCC(CO)C3)c[nH]c12.
What is the InChIKey of [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol?
The InChIKey is KGHFZYKFYRVWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-2-14-6-3-7-16-15(9-18-17(14)16)11-19-8-4-5-13(10-19)12-20/h3,6-7,9,13,18,20H,2,4-5,8,10-12H2,1H3.
What are the key properties of [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol?
[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol has a molecular weight of 272.39 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol is sourced from PubChem (CID 110244912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).