4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane

C16H28ClNO — CID 144802355

IUPAC4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane
SMILESCC.CC.CN1CCC(O)(c2cccc(Cl)c2)CC1
InChIInChI=1S/C12H16ClNO.2C2H6/c1-14-7-5-12(15,6-8-14)10-3-2-4-11(13)9-10;2*1-2/h2-4,9,15H,5-8H2,1H3;2*1-2H3
InChIKeyGWFWHMHDDICFQW-UHFFFAOYSA-N
MW285.86 g/mol
LogP4.31
Rot. Bonds1

About 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane

4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane (PubChem CID 144802355) has the molecular formula C16H28ClNO and a molecular weight of 285.86 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane.

Molecular Properties

Compound Name4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane
PubChem CID144802355
Molecular FormulaC16H28ClNO
Molecular Weight285.86 g/mol
Exact Mass285.19
IUPAC Name4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane
SMILESCC.CC.CN1CCC(O)(c2cccc(Cl)c2)CC1
InChIInChI=1S/C12H16ClNO.2C2H6/c1-14-7-5-12(15,6-8-14)10-3-2-4-11(13)9-10;2*1-2/h2-4,9,15H,5-8H2,1H3;2*1-2H3
InChIKeyGWFWHMHDDICFQW-UHFFFAOYSA-N
XLogP4.31
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.86
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-hydroxy-1-methylpiperidin-4-yl)benzaldehyde
CID 105474106
1-methyl-4-[3-(trifluoromethyl)phenyl]piperidin-4-ol;hydroiodide
CID 171929292
4-(3-chlorophenyl)-1-[(2-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-ol
CID 169137807
4-[4-(3-chlorophenyl)-4-hydroxypiperidin-1-yl]butanehydrazide
CID 54336798
1-chloro-3-(1-methylcyclopropyl)benzene;ethane
CID 171088326
[4-(3-chlorophenyl)-1-methylpiperidin-4-yl] ethyl carbonate
CID 10827897
(2R,9aS)-2-(3-chlorophenyl)-1,3,4,6,7,8,9,9a-octahydroquinolizin-2-ol
CID 129396439
1-methyl-4-pyridin-3-ylpiperidin-4-ol
CID 4172974
4-(4-chlorophenyl)-1-methylpiperidin-4-ol;2-methyl-3,4-dihydro-1H-isoquinoline
CID 158541469
4-(3-cyclopropyloxyphenyl)-1-methylazepan-4-ol
CID 114520909
4-(3-chlorophenyl)-2,6-dimethylpiperidin-4-ol
CID 170108590
4-(3-chloro-2-methylphenyl)-1-methylpiperidin-4-ol
CID 83824769

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane?
The IUPAC name of 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane (CID 144802355) is 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane.
What is the SMILES notation for 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane?
The canonical SMILES for 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane is CC.CC.CN1CCC(O)(c2cccc(Cl)c2)CC1.
What is the InChIKey of 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane?
The InChIKey is GWFWHMHDDICFQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO.2C2H6/c1-14-7-5-12(15,6-8-14)10-3-2-4-11(13)9-10;2*1-2/h2-4,9,15H,5-8H2,1H3;2*1-2H3.
What are the key properties of 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane?
4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane has a molecular weight of 285.86 g/mol, XLogP of 4.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-1-methylpiperidin-4-ol;ethane is sourced from PubChem (CID 144802355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).