2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol

C14H20ClNO — CID 54776185

IUPAC2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol
SMILESCC(CO)(c1ccccc1Cl)N1CCCCC1
InChIInChI=1S/C14H20ClNO/c1-14(11-17,16-9-5-2-6-10-16)12-7-3-4-8-13(12)15/h3-4,7-8,17H,2,5-6,9-11H2,1H3
InChIKeyQYPPYSKWZCMIKW-UHFFFAOYSA-N
MW253.77 g/mol
LogP3.03
Rot. Bonds3

About 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol

2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol (PubChem CID 54776185) has the molecular formula C14H20ClNO and a molecular weight of 253.77 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol.

Molecular Properties

Compound Name2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol
PubChem CID54776185
Molecular FormulaC14H20ClNO
Molecular Weight253.77 g/mol
Exact Mass253.12
IUPAC Name2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol
SMILESCC(CO)(c1ccccc1Cl)N1CCCCC1
InChIInChI=1S/C14H20ClNO/c1-14(11-17,16-9-5-2-6-10-16)12-7-3-4-8-13(12)15/h3-4,7-8,17H,2,5-6,9-11H2,1H3
InChIKeyQYPPYSKWZCMIKW-UHFFFAOYSA-N
XLogP3.03
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.77
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dichlorophenyl)-2-piperazin-1-ylpropan-1-ol
CID 114079755
2-piperazin-1-yl-2-[2-(trifluoromethyl)phenyl]propan-1-ol
CID 61054698
2-amino-2-(2-chlorophenyl)propan-1-ol
CID 54776181
3-(azepan-1-yl)-3-(2,5-dichlorophenyl)butanoic acid
CID 64527529
3-(2,5-dichlorophenyl)-3-piperidin-1-ylbutanoic acid
CID 64526651
2-(azepan-1-yl)-1-(2-chlorophenyl)propan-2-amine
CID 84752536
1,1-bis(2-chlorophenyl)ethane-1,2-diol
CID 71341574
2-(2-chlorophenyl)propan-2-ol
CID 12759846
3-(azepan-1-yl)-3-(2-methoxyphenyl)butanoic acid
CID 64527131
2-(azepan-1-yl)-3-(2-chlorophenyl)-2-methylpropanoic acid
CID 84746800
2-(4-chlorophenyl)-2-(1,4-diazepan-1-yl)propan-1-ol
CID 61049034
2-(2-chlorophenyl)-2-(ethylamino)propan-1-ol
CID 61050515

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol?
The IUPAC name of 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol (CID 54776185) is 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol.
What is the SMILES notation for 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol?
The canonical SMILES for 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol is CC(CO)(c1ccccc1Cl)N1CCCCC1.
What is the InChIKey of 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol?
The InChIKey is QYPPYSKWZCMIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO/c1-14(11-17,16-9-5-2-6-10-16)12-7-3-4-8-13(12)15/h3-4,7-8,17H,2,5-6,9-11H2,1H3.
What are the key properties of 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol?
2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol has a molecular weight of 253.77 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-ol is sourced from PubChem (CID 54776185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).