[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol

C15H20N2O — CID 43817859

IUPAC[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol
SMILESOCC1CCCN(Cc2c[nH]c3ccccc23)C1
InChIInChI=1S/C15H20N2O/c18-11-12-4-3-7-17(9-12)10-13-8-16-15-6-2-1-5-14(13)15/h1-2,5-6,8,12,16,18H,3-4,7,9-11H2
InChIKeyKRIDCXMQJUMNJH-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.37
Rot. Bonds3

About [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol

[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol (PubChem CID 43817859) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol
PubChem CID43817859
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol
SMILESOCC1CCCN(Cc2c[nH]c3ccccc23)C1
InChIInChI=1S/C15H20N2O/c18-11-12-4-3-7-17(9-12)10-13-8-16-15-6-2-1-5-14(13)15/h1-2,5-6,8,12,16,18H,3-4,7,9-11H2
InChIKeyKRIDCXMQJUMNJH-UHFFFAOYSA-N
XLogP2.37
TPSA39.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methyl]propan-2-amine
CID 63240913
[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol
CID 110244912
azepan-1-yl-[(3R)-1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanone
CID 898620
[(3R)-1-[(3-methyl-1H-indol-2-yl)methyl]piperidin-3-yl]methanol
CID 95857188
1-(1H-indol-3-ylmethyl)-N,N-di(propan-2-yl)piperidine-3-carboxamide;hydrochloride
CID 3030428
[(3S)-1-[(2-bromophenyl)methyl]piperidin-3-yl]methanol
CID 40514210
1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol
CID 3054781
2-[[(3R)-3-(hydroxymethyl)piperidin-1-yl]methyl]benzonitrile
CID 86311278
(3aS,6aR)-2-(1H-indol-3-ylmethyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-ol
CID 110126404
N-[(2,4-dimethoxyphenyl)methyl]-3-[1-(1H-indol-3-ylmethyl)piperidin-3-yl]propanamide
CID 45218347
2-[(2R)-4-(1H-indol-3-ylmethyl)-1-propan-2-ylpiperazin-2-yl]ethanol
CID 98579746
4-[[3-(2-hydroxypropan-2-yl)piperidin-1-yl]methyl]-2H-isoquinolin-1-one
CID 166265372

Frequently Asked Questions

What is the IUPAC name of [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol?
The IUPAC name of [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol (CID 43817859) is [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol is OCC1CCCN(Cc2c[nH]c3ccccc23)C1.
What is the InChIKey of [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol?
The InChIKey is KRIDCXMQJUMNJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c18-11-12-4-3-7-17(9-12)10-13-8-16-15-6-2-1-5-14(13)15/h1-2,5-6,8,12,16,18H,3-4,7,9-11H2.
What are the key properties of [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol?
[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol has a molecular weight of 244.34 g/mol, XLogP of 2.37, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol is sourced from PubChem (CID 43817859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).