[2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol

C14H20ClNO — CID 62331045

IUPAC[2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol
SMILESCC1CCN(c2cccc(Cl)c2CO)C(C)C1
InChIInChI=1S/C14H20ClNO/c1-10-6-7-16(11(2)8-10)14-5-3-4-13(15)12(14)9-17/h3-5,10-11,17H,6-9H2,1-2H3
InChIKeyJDBXSVPNIJUFSN-UHFFFAOYSA-N
MW253.77 g/mol
LogP3.46
Rot. Bonds2

About [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol

[2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol (PubChem CID 62331045) has the molecular formula C14H20ClNO and a molecular weight of 253.77 g/mol. Its IUPAC name is [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol
PubChem CID62331045
Molecular FormulaC14H20ClNO
Molecular Weight253.77 g/mol
Exact Mass253.12
IUPAC Name[2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol
SMILESCC1CCN(c2cccc(Cl)c2CO)C(C)C1
InChIInChI=1S/C14H20ClNO/c1-10-6-7-16(11(2)8-10)14-5-3-4-13(15)12(14)9-17/h3-5,10-11,17H,6-9H2,1-2H3
InChIKeyJDBXSVPNIJUFSN-UHFFFAOYSA-N
XLogP3.46
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.77
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanamine
CID 55134862
[2-chloro-6-(2-methylpyrrolidin-1-yl)phenyl]methanol
CID 60974509
[2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-6-chlorophenyl]methanol
CID 82750860
[2-chloro-6-[4-(dimethylamino)piperidin-1-yl]phenyl]methanol
CID 43586235
1-[2-(2,4-dimethylpiperidin-1-yl)phenyl]ethanol
CID 55061562
[2-chloro-6-(4-propylpiperidin-1-yl)phenyl]methanol
CID 55050268
2-[2-chloro-6-(2-methylpiperidin-1-yl)phenyl]ethanamine
CID 63783024
[2-chloro-6-(4-ethoxypiperidin-1-yl)phenyl]methanol
CID 61221101
[2-chloro-6-(2,3-dihydroindol-1-yl)phenyl]methanol
CID 28945727
[2-chloro-6-(4-methylsulfonylpiperazin-1-yl)phenyl]methanol
CID 62993803
(2-chloro-6-thiomorpholin-4-ylphenyl)methanol
CID 43121109
N-[[2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]propan-2-amine
CID 62331056

Frequently Asked Questions

What is the IUPAC name of [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol?
The IUPAC name of [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol (CID 62331045) is [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol.
What is the SMILES notation for [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol?
The canonical SMILES for [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol is CC1CCN(c2cccc(Cl)c2CO)C(C)C1.
What is the InChIKey of [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol?
The InChIKey is JDBXSVPNIJUFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO/c1-10-6-7-16(11(2)8-10)14-5-3-4-13(15)12(14)9-17/h3-5,10-11,17H,6-9H2,1-2H3.
What are the key properties of [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol?
[2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol has a molecular weight of 253.77 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-6-(2,4-dimethylpiperidin-1-yl)phenyl]methanol is sourced from PubChem (CID 62331045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).