1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol

C15H20FNO — CID 167714126

IUPAC1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol
SMILESCc1ccc(C2(N3CCC(O)CC3)CC2)cc1F
InChIInChI=1S/C15H20FNO/c1-11-2-3-12(10-14(11)16)15(6-7-15)17-8-4-13(18)5-9-17/h2-3,10,13,18H,4-9H2,1H3
InChIKeyCVQDOHGLQPIDGJ-UHFFFAOYSA-N
MW249.33 g/mol
LogP2.58
Rot. Bonds2

About 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol

1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol (PubChem CID 167714126) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol
PubChem CID167714126
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC Name1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol
SMILESCc1ccc(C2(N3CCC(O)CC3)CC2)cc1F
InChIInChI=1S/C15H20FNO/c1-11-2-3-12(10-14(11)16)15(6-7-15)17-8-4-13(18)5-9-17/h2-3,10,13,18H,4-9H2,1H3
InChIKeyCVQDOHGLQPIDGJ-UHFFFAOYSA-N
XLogP2.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol?
The IUPAC name of 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol (CID 167714126) is 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol.
What is the SMILES notation for 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol?
The canonical SMILES for 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol is Cc1ccc(C2(N3CCC(O)CC3)CC2)cc1F.
What is the InChIKey of 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol?
The InChIKey is CVQDOHGLQPIDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c1-11-2-3-12(10-14(11)16)15(6-7-15)17-8-4-13(18)5-9-17/h2-3,10,13,18H,4-9H2,1H3.
What are the key properties of 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol?
1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol has a molecular weight of 249.33 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3-fluoro-4-methylphenyl)cyclopropyl]piperidin-4-ol is sourced from PubChem (CID 167714126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).