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

C17H25NO — CID 117403000

IUPAC1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol
SMILESOC1(Cc2ccc(CCN3CCCCC3)cc2)CC1
InChIInChI=1S/C17H25NO/c19-17(9-10-17)14-16-6-4-15(5-7-16)8-13-18-11-2-1-3-12-18/h4-7,19H,1-3,8-14H2
InChIKeyJSHAIHWIEBQQPX-UHFFFAOYSA-N
MW259.39 g/mol
LogP2.78
Rot. Bonds5

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

1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol (PubChem CID 117403000) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol
PubChem CID117403000
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol
SMILESOC1(Cc2ccc(CCN3CCCCC3)cc2)CC1
InChIInChI=1S/C17H25NO/c19-17(9-10-17)14-16-6-4-15(5-7-16)8-13-18-11-2-1-3-12-18/h4-7,19H,1-3,8-14H2
InChIKeyJSHAIHWIEBQQPX-UHFFFAOYSA-N
XLogP2.78
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[[4-(2-morpholin-4-ylethyl)phenyl]methyl]cyclopropan-1-ol
CID 117408221
1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-amine
CID 117400107
1-[2-(4-hydroxysulfanylphenyl)ethyl]piperidine
CID 57495495
1-[4-(2-piperidin-1-ylethyl)phenyl]cyclobutan-1-amine
CID 117400009
1-[2-(4-chlorophenyl)ethyl]pyrrolidine
CID 22364204
1-[[4-[4-(2-piperidin-1-ylethyl)phenyl]phenyl]methyl]piperidine
CID 25147728
bis[4-(2-pyrrolidin-1-ylethyl)phenyl]methanone
CID 57106697
1-[4-(2-pyrrolidin-1-ylethyl)phenyl]cyclopentane-1-carboxylic acid
CID 117463972
1-[[4-[2-(dimethylamino)ethyl]phenyl]methyl]cyclopropan-1-ol
CID 117313193
1-[2-(4-octylphenyl)ethyl]azepane
CID 71546091
1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]piperidin-4-ol
CID 71034592
1-[2-[4-(1-isocyanatocyclopropyl)phenyl]ethyl]piperidine
CID 117429353

Frequently Asked Questions

What is the IUPAC name of 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol?
The IUPAC name of 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol (CID 117403000) is 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol is OC1(Cc2ccc(CCN3CCCCC3)cc2)CC1.
What is the InChIKey of 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol?
The InChIKey is JSHAIHWIEBQQPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c19-17(9-10-17)14-16-6-4-15(5-7-16)8-13-18-11-2-1-3-12-18/h4-7,19H,1-3,8-14H2.
What are the key properties of 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol?
1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol has a molecular weight of 259.39 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol is sourced from PubChem (CID 117403000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).