1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol

C15H21NO — CID 29021859

IUPAC1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2(c3ccccc3)CC2)CC1
InChIInChI=1S/C15H21NO/c17-14-6-10-16(11-7-14)12-15(8-9-15)13-4-2-1-3-5-13/h1-5,14,17H,6-12H2
InChIKeyJGFAOTZKLBESIT-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.17
Rot. Bonds3

About 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol

1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol (PubChem CID 29021859) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol
PubChem CID29021859
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol
SMILESOC1CCN(CC2(c3ccccc3)CC2)CC1
InChIInChI=1S/C15H21NO/c17-14-6-10-16(11-7-14)12-15(8-9-15)13-4-2-1-3-5-13/h1-5,14,17H,6-12H2
InChIKeyJGFAOTZKLBESIT-UHFFFAOYSA-N
XLogP2.17
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol (CID 29021859) is 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol is OC1CCN(CC2(c3ccccc3)CC2)CC1.
What is the InChIKey of 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol?
The InChIKey is JGFAOTZKLBESIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c17-14-6-10-16(11-7-14)12-15(8-9-15)13-4-2-1-3-5-13/h1-5,14,17H,6-12H2.
What are the key properties of 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol?
1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol has a molecular weight of 231.34 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-phenylcyclopropyl)methyl]piperidin-4-ol is sourced from PubChem (CID 29021859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).