(3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol

C12H16ClNO — CID 67190676

IUPAC(3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol
SMILESOC(c1cccc(Cl)c1)[C@@H]1CCCNC1
InChIInChI=1S/C12H16ClNO/c13-11-5-1-3-9(7-11)12(15)10-4-2-6-14-8-10/h1,3,5,7,10,12,14-15H,2,4,6,8H2/t10-,12?/m1/s1
InChIKeyBHQGJNZRZNSKEH-RWANSRKNSA-N
MW225.72 g/mol
LogP2.37
Rot. Bonds2

About (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol

(3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol (PubChem CID 67190676) has the molecular formula C12H16ClNO and a molecular weight of 225.72 g/mol. Its IUPAC name is (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol.

Molecular Properties

Compound Name(3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol
PubChem CID67190676
Molecular FormulaC12H16ClNO
Molecular Weight225.72 g/mol
Exact Mass225.09
IUPAC Name(3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol
SMILESOC(c1cccc(Cl)c1)[C@@H]1CCCNC1
InChIInChI=1S/C12H16ClNO/c13-11-5-1-3-9(7-11)12(15)10-4-2-6-14-8-10/h1,3,5,7,10,12,14-15H,2,4,6,8H2/t10-,12?/m1/s1
InChIKeyBHQGJNZRZNSKEH-RWANSRKNSA-N
XLogP2.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-(3-chlorophenyl)ethyl]piperidine
CID 83910984
(R)-phenyl-[(3S)-piperidin-3-yl]methanol
CID 39238461
(4-fluoro-3-methylphenyl)-piperidin-3-ylmethanol
CID 79023931
(4-methylphenyl)-piperidin-3-ylmethanol
CID 43146496
2-[(3-chlorophenyl)-piperidin-3-ylmethoxy]butanamide
CID 91159436
1-(3-chlorophenyl)-2-cyclohexylethane-1,2-diol
CID 103459098
(R)-(3-chlorophenyl)-piperidin-4-ylmethanamine
CID 171314128
azepan-4-yl-(4-chlorophenyl)methanol
CID 84701681
N-[1-(3-chlorophenyl)ethyl]piperidine-3-carboxamide
CID 54913857
(2S)-2-(3-chlorophenyl)-2-[(3R)-piperidin-3-yl]oxyacetamide
CID 99980721
(3R)-N-[1-(3-chlorophenyl)ethyl]piperidine-3-carboxamide
CID 81128625
2,3-dihydro-1-benzofuran-5-yl(piperidin-3-yl)methanol
CID 43146492

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol?
The IUPAC name of (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol (CID 67190676) is (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol.
What is the SMILES notation for (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol?
The canonical SMILES for (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol is OC(c1cccc(Cl)c1)[C@@H]1CCCNC1.
What is the InChIKey of (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol?
The InChIKey is BHQGJNZRZNSKEH-RWANSRKNSA-N. The full InChI is InChI=1S/C12H16ClNO/c13-11-5-1-3-9(7-11)12(15)10-4-2-6-14-8-10/h1,3,5,7,10,12,14-15H,2,4,6,8H2/t10-,12?/m1/s1.
What are the key properties of (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol?
(3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol has a molecular weight of 225.72 g/mol, XLogP of 2.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol is sourced from PubChem (CID 67190676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).