1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol

C15H21NO — CID 117117835

IUPAC1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol
SMILESOC1(c2ccccc2CC2CCNCC2)CC1
InChIInChI=1S/C15H21NO/c17-15(7-8-15)14-4-2-1-3-13(14)11-12-5-9-16-10-6-12/h1-4,12,16-17H,5-11H2
InChIKeySNGJWZIUIQSPOR-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.21
Rot. Bonds3

About 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol

1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol (PubChem CID 117117835) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol
PubChem CID117117835
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol
SMILESOC1(c2ccccc2CC2CCNCC2)CC1
InChIInChI=1S/C15H21NO/c17-15(7-8-15)14-4-2-1-3-13(14)11-12-5-9-16-10-6-12/h1-4,12,16-17H,5-11H2
InChIKeySNGJWZIUIQSPOR-UHFFFAOYSA-N
XLogP2.21
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-(piperidin-4-ylmethyl)phenyl]piperidine
CID 117399981
[2-(piperidin-4-ylmethyl)phenyl]methanamine
CID 105456757
1-[2-(fluoromethyl)phenyl]cyclopropan-1-ol
CID 117276392
4-[(2-fluorophenyl)methyl]piperidine;hydrochloride
CID 46172843
2-(pyrrolidin-3-ylmethyl)phenol
CID 82599560
4-amino-1-(2-benzylphenyl)cyclohexan-1-ol
CID 12831591
[2-(1-hydroxycyclohexyl)phenyl]-piperidin-4-ylmethanone
CID 141436195
4-[[3-fluoro-2-(2-fluorophenoxy)phenyl]methyl]piperidine
CID 18669380
4-[2-(piperidin-4-ylmethyl)phenyl]piperazine-2,6-dione
CID 117463844
4-[[3-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidine
CID 84806750
4-[[2-(difluoromethoxy)phenyl]methyl]piperidine
CID 117355180
[1-(2-piperidin-4-ylphenyl)cyclopropyl]methanol
CID 117116545

Frequently Asked Questions

What is the IUPAC name of 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol?
The IUPAC name of 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol (CID 117117835) is 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol?
The canonical SMILES for 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol is OC1(c2ccccc2CC2CCNCC2)CC1.
What is the InChIKey of 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol?
The InChIKey is SNGJWZIUIQSPOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c17-15(7-8-15)14-4-2-1-3-13(14)11-12-5-9-16-10-6-12/h1-4,12,16-17H,5-11H2.
What are the key properties of 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol?
1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol has a molecular weight of 231.34 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(piperidin-4-ylmethyl)phenyl]cyclopropan-1-ol is sourced from PubChem (CID 117117835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).