[2-chloro-6-(piperidin-4-ylamino)phenyl]methanol

C12H17ClN2O — CID 11460089

IUPAC[2-chloro-6-(piperidin-4-ylamino)phenyl]methanol
SMILESOCc1c(Cl)cccc1NC1CCNCC1
InChIInChI=1S/C12H17ClN2O/c13-11-2-1-3-12(10(11)8-16)15-9-4-6-14-7-5-9/h1-3,9,14-16H,4-8H2
InChIKeySRINBRVYEORQIV-UHFFFAOYSA-N
MW240.73 g/mol
LogP2.00
Rot. Bonds3

About [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol

[2-chloro-6-(piperidin-4-ylamino)phenyl]methanol (PubChem CID 11460089) has the molecular formula C12H17ClN2O and a molecular weight of 240.73 g/mol. Its IUPAC name is [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol.

Molecular Properties

Compound Name[2-chloro-6-(piperidin-4-ylamino)phenyl]methanol
PubChem CID11460089
Molecular FormulaC12H17ClN2O
Molecular Weight240.73 g/mol
Exact Mass240.10
IUPAC Name[2-chloro-6-(piperidin-4-ylamino)phenyl]methanol
SMILESOCc1c(Cl)cccc1NC1CCNCC1
InChIInChI=1S/C12H17ClN2O/c13-11-2-1-3-12(10(11)8-16)15-9-4-6-14-7-5-9/h1-3,9,14-16H,4-8H2
InChIKeySRINBRVYEORQIV-UHFFFAOYSA-N
XLogP2.00
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol?
The IUPAC name of [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol (CID 11460089) is [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol.
What is the SMILES notation for [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol?
The canonical SMILES for [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol is OCc1c(Cl)cccc1NC1CCNCC1.
What is the InChIKey of [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol?
The InChIKey is SRINBRVYEORQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O/c13-11-2-1-3-12(10(11)8-16)15-9-4-6-14-7-5-9/h1-3,9,14-16H,4-8H2.
What are the key properties of [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol?
[2-chloro-6-(piperidin-4-ylamino)phenyl]methanol has a molecular weight of 240.73 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-6-(piperidin-4-ylamino)phenyl]methanol is sourced from PubChem (CID 11460089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).