2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol

C18H27NO — CID 62610936

IUPAC2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol
SMILESOC1CCCC1CN1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C18H27NO/c20-18-8-4-7-17(18)14-19-11-9-16(10-12-19)13-15-5-2-1-3-6-15/h1-3,5-6,16-18,20H,4,7-14H2
InChIKeyNFQKKXLMSISFSV-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.10
Rot. Bonds4

About 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol

2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol (PubChem CID 62610936) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol
PubChem CID62610936
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol
SMILESOC1CCCC1CN1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C18H27NO/c20-18-8-4-7-17(18)14-19-11-9-16(10-12-19)13-15-5-2-1-3-6-15/h1-3,5-6,16-18,20H,4,7-14H2
InChIKeyNFQKKXLMSISFSV-UHFFFAOYSA-N
XLogP3.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-benzylpiperidin-1-yl)methyl]cyclohexan-1-ol
CID 62610935
cis-(1R,2S)-2-[(4-benzylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 131851979
4-benzyl-1-(cyclopentylmethyl)piperidine
CID 82089376
trans-(1S,2S)-2-[(4-phenylpiperidin-1-yl)methyl]cyclohexan-1-ol
CID 70691042
1-(2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-ylmethyl)-4-benzylpiperidine
CID 162283808
cis-(1R,2S)-2-(pyrrolidin-1-ylmethyl)cyclopentan-1-ol
CID 10899101
2-(4-benzylpiperidin-1-yl)acetamide
CID 6465422
2-[[4-(hydroxymethyl)piperidin-1-yl]methyl]cyclohexan-1-ol
CID 62610386
4-benzyl-1-[[(1R)-4-ethylcyclooctyl]methyl]piperidine
CID 142080658
1-(4-benzylpiperidin-1-yl)-2-methylpropan-2-ol
CID 39350302
2-[[3-(2-hydroxyethyl)pyrrolidin-1-yl]methyl]cyclopentan-1-ol
CID 114800248
dilithium bis(2-(4-benzylpiperidin-1-yl)acetate)
CID 162364859

Frequently Asked Questions

What is the IUPAC name of 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol (CID 62610936) is 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol is OC1CCCC1CN1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol?
The InChIKey is NFQKKXLMSISFSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c20-18-8-4-7-17(18)14-19-11-9-16(10-12-19)13-15-5-2-1-3-6-15/h1-3,5-6,16-18,20H,4,7-14H2.
What are the key properties of 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol?
2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol has a molecular weight of 273.42 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-benzylpiperidin-1-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 62610936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).