[1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol

C10H18ClNO — CID 106439839

IUPAC[1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol
SMILESCC(=CCl)CN1CCCCC1CO
InChIInChI=1S/C10H18ClNO/c1-9(6-11)7-12-5-3-2-4-10(12)8-13/h6,10,13H,2-5,7-8H2,1H3
InChIKeyMXRMEZDEACVPRH-UHFFFAOYSA-N
MW203.71 g/mol
LogP1.98
Rot. Bonds3

About [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol

[1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol (PubChem CID 106439839) has the molecular formula C10H18ClNO and a molecular weight of 203.71 g/mol. Its IUPAC name is [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol
PubChem CID106439839
Molecular FormulaC10H18ClNO
Molecular Weight203.71 g/mol
Exact Mass203.11
IUPAC Name[1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol
SMILESCC(=CCl)CN1CCCCC1CO
InChIInChI=1S/C10H18ClNO/c1-9(6-11)7-12-5-3-2-4-10(12)8-13/h6,10,13H,2-5,7-8H2,1H3
InChIKeyMXRMEZDEACVPRH-UHFFFAOYSA-N
XLogP1.98
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.71
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]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 [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol?
The IUPAC name of [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol (CID 106439839) is [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol is CC(=CCl)CN1CCCCC1CO.
What is the InChIKey of [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol?
The InChIKey is MXRMEZDEACVPRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18ClNO/c1-9(6-11)7-12-5-3-2-4-10(12)8-13/h6,10,13H,2-5,7-8H2,1H3.
What are the key properties of [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol?
[1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol has a molecular weight of 203.71 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-2-methylprop-2-enyl)piperidin-2-yl]methanol is sourced from PubChem (CID 106439839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).