[1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol

C14H21N3O — CID 116976106

IUPAC[1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol
SMILESOCC1CCCN(c2ncc(C3CCC3)cn2)C1
InChIInChI=1S/C14H21N3O/c18-10-11-3-2-6-17(9-11)14-15-7-13(8-16-14)12-4-1-5-12/h7-8,11-12,18H,1-6,9-10H2
InChIKeyGBBGZMMXQIPDJY-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.95
Rot. Bonds3

About [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol

[1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol (PubChem CID 116976106) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol
PubChem CID116976106
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name[1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol
SMILESOCC1CCCN(c2ncc(C3CCC3)cn2)C1
InChIInChI=1S/C14H21N3O/c18-10-11-3-2-6-17(9-11)14-15-7-13(8-16-14)12-4-1-5-12/h7-8,11-12,18H,1-6,9-10H2
InChIKeyGBBGZMMXQIPDJY-UHFFFAOYSA-N
XLogP1.95
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-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

Related Compounds

[1-(5-cyclohexylpyrimidin-2-yl)pyrrolidin-3-yl]methanol
CID 116976618
1-(5-cyclobutylpyrimidin-2-yl)piperidine-3-carboxylic acid
CID 116976080
1-[1-(5-cyclopentylpyrimidin-2-yl)pyrrolidin-3-yl]-N-methylmethanamine
CID 116976804
2-[3-(methoxymethyl)piperidin-1-yl]pyrimidin-5-amine
CID 106585802
[1-[5-(hydroxymethyl)pyrazin-2-yl]piperidin-3-yl]methanol
CID 107372633
[1-(5-amino-1,3-thiazol-2-yl)piperidin-3-yl]methanol
CID 102767699
[1-(5-methyl-1,3-thiazol-2-yl)piperidin-3-yl]methanol
CID 175647955
[1-(1,2,4-thiadiazol-5-yl)piperidin-3-yl]methanol
CID 65275221
2-[1-(5-cyclopentylpyrimidin-2-yl)pyrrolidin-2-yl]ethanol
CID 116976703
[1-[4-(diethylamino)-1,3,5-triazin-2-yl]piperidin-3-yl]methanol
CID 57067375
[(3S)-1-(4-chloro-6-methylpyrimidin-2-yl)piperidin-3-yl]methanol
CID 86329185
[1-(5-bromo-3-methyl-2-pyridinyl)piperidin-3-yl]methanol
CID 79719028

Frequently Asked Questions

What is the IUPAC name of [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol?
The IUPAC name of [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol (CID 116976106) is [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol is OCC1CCCN(c2ncc(C3CCC3)cn2)C1.
What is the InChIKey of [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol?
The InChIKey is GBBGZMMXQIPDJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c18-10-11-3-2-6-17(9-11)14-15-7-13(8-16-14)12-4-1-5-12/h7-8,11-12,18H,1-6,9-10H2.
What are the key properties of [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol?
[1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol has a molecular weight of 247.34 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-cyclobutylpyrimidin-2-yl)piperidin-3-yl]methanol is sourced from PubChem (CID 116976106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).