[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol

C16H23NO — CID 110899348

IUPAC[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol
SMILESOCC1CCN(C2CCCc3ccccc32)CC1
InChIInChI=1S/C16H23NO/c18-12-13-8-10-17(11-9-13)16-7-3-5-14-4-1-2-6-15(14)16/h1-2,4,6,13,16,18H,3,5,7-12H2
InChIKeyXMDFZGPKPXOPCB-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.77
Rot. Bonds2

About [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol

[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol (PubChem CID 110899348) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol
PubChem CID110899348
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol
SMILESOCC1CCN(C2CCCc3ccccc32)CC1
InChIInChI=1S/C16H23NO/c18-12-13-8-10-17(11-9-13)16-7-3-5-14-4-1-2-6-15(14)16/h1-2,4,6,13,16,18H,3,5,7-12H2
InChIKeyXMDFZGPKPXOPCB-UHFFFAOYSA-N
XLogP2.77
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine
CID 122364481
1-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine
CID 141000985
1-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]ethanol
CID 111113908
[1-(2,3,4,5-tetrahydro-1H-2-benzazepin-5-yl)piperidin-4-yl]methanol
CID 103983164
1-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,5-diazocane
CID 62316741
[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)piperidin-4-yl]methanol
CID 55242278
N-[[1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 62522961
(3R)-1-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-3-carboxylic acid
CID 124778185
2-[4-(1,2,3,4-tetrahydronaphthalen-1-yl)piperazin-1-yl]ethanamine
CID 10515461
1-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-3-carboxylic acid;hydrochloride
CID 119904120
4-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,5-diazocane
CID 62316210
1-(1,2,3,4-tetrahydronaphthalen-1-yl)azetidine-3-carboxylic acid
CID 65072102

Frequently Asked Questions

What is the IUPAC name of [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol?
The IUPAC name of [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol (CID 110899348) is [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol is OCC1CCN(C2CCCc3ccccc32)CC1.
What is the InChIKey of [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol?
The InChIKey is XMDFZGPKPXOPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c18-12-13-8-10-17(11-9-13)16-7-3-5-14-4-1-2-6-15(14)16/h1-2,4,6,13,16,18H,3,5,7-12H2.
What are the key properties of [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol?
[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol has a molecular weight of 245.37 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 110899348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).