3-(3-hydroxy-2-methylpropyl)piperidin-4-ol

C9H19NO2 — CID 114451948

IUPAC3-(3-hydroxy-2-methylpropyl)piperidin-4-ol
SMILESCC(CO)CC1CNCCC1O
InChIInChI=1S/C9H19NO2/c1-7(6-11)4-8-5-10-3-2-9(8)12/h7-12H,2-6H2,1H3
InChIKeyJNHOETIUPQSCKV-UHFFFAOYSA-N
MW173.26 g/mol
LogP-0.02
Rot. Bonds3

About 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol

3-(3-hydroxy-2-methylpropyl)piperidin-4-ol (PubChem CID 114451948) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol.

Molecular Properties

Compound Name3-(3-hydroxy-2-methylpropyl)piperidin-4-ol
PubChem CID114451948
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-(3-hydroxy-2-methylpropyl)piperidin-4-ol
SMILESCC(CO)CC1CNCCC1O
InChIInChI=1S/C9H19NO2/c1-7(6-11)4-8-5-10-3-2-9(8)12/h7-12H,2-6H2,1H3
InChIKeyJNHOETIUPQSCKV-UHFFFAOYSA-N
XLogP-0.02
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol with MolForge

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

Launch Full Analysis

Related Compounds

(3S,4S)-3-(2-methylpropyl)piperidin-4-ol
CID 93495959
(3R,4R)-3-(2-methylpropyl)piperidin-4-ol
CID 93495960
ethane;3-(2-methylpropyl)piperidin-4-ol
CID 143575873
3-(2-methoxypropyl)piperidin-4-ol
CID 114451812
3-(2-hydroxy-3-methoxypropyl)piperidin-4-ol
CID 114451767
(3S,4S)-3-(cyclopropylmethyl)piperidin-4-ol
CID 129393768
3-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-ol
CID 114451747
3-[2-(2-hydroxyethoxy)ethyl]piperidin-4-ol
CID 114451802
3-[(1-butan-2-ylpyrazol-3-yl)methyl]piperidin-4-ol
CID 114451905
3-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-ol
CID 114451772
2-[methyl(pyrrolidin-3-yl)amino]propan-1-ol
CID 104556943
(2S)-3-methyl-2-(pyrrolidin-3-ylamino)butan-1-ol
CID 79742166

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol?
The IUPAC name of 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol (CID 114451948) is 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol.
What is the SMILES notation for 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol?
The canonical SMILES for 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol is CC(CO)CC1CNCCC1O.
What is the InChIKey of 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol?
The InChIKey is JNHOETIUPQSCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-7(6-11)4-8-5-10-3-2-9(8)12/h7-12H,2-6H2,1H3.
What are the key properties of 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol?
3-(3-hydroxy-2-methylpropyl)piperidin-4-ol has a molecular weight of 173.26 g/mol, XLogP of -0.02, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxy-2-methylpropyl)piperidin-4-ol is sourced from PubChem (CID 114451948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).