[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol

C13H23N3O2 — CID 70748958

IUPAC[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol
SMILESCCCC1(CO)CCCN(Cc2nc(C)no2)C1
InChIInChI=1S/C13H23N3O2/c1-3-5-13(10-17)6-4-7-16(9-13)8-12-14-11(2)15-18-12/h17H,3-10H2,1-2H3
InChIKeyCLHHNCYFHYRWMA-UHFFFAOYSA-N
MW253.35 g/mol
LogP1.75
Rot. Bonds5

About [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol

[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol (PubChem CID 70748958) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol
PubChem CID70748958
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol
SMILESCCCC1(CO)CCCN(Cc2nc(C)no2)C1
InChIInChI=1S/C13H23N3O2/c1-3-5-13(10-17)6-4-7-16(9-13)8-12-14-11(2)15-18-12/h17H,3-10H2,1-2H3
InChIKeyCLHHNCYFHYRWMA-UHFFFAOYSA-N
XLogP1.75
TPSA62.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-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

N-methyl-N-{[3-(3-methylbutyl)-1,2,4-oxadiazol-5-yl]methyl}-2-(tetrahydro-2H-pyran-4-yl)ethanamine
CID 16190461
(1-((3-Isobutyl-1,2,4-oxadiazol-5-yl)methyl)piperidin-4-yl)methanol
CID 51080715
2-[4-[[Methyl-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]amino]methyl]piperidin-1-yl]ethanol
CID 53589139
(1R,3S)-3-methoxy-7-[[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl]-7-azaspiro[3.5]nonan-1-ol
CID 70714063
(1R,3S)-3-methoxy-7-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-7-azaspiro[3.5]nonan-1-ol
CID 70767183
[3-Methyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-yl]methanol
CID 84589411
{1-[(3-Methyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl}methanol
CID 45822598
1-((3-(Tert-butyl)-1,2,4-oxadiazol-5-yl)methyl)piperidin-4-ol
CID 45806841
(1-((3-Isopropyl-1,2,4-oxadiazol-5-yl)methyl)piperidin-4-yl)methanol
CID 47035135
[1-[(3-Cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]methanol
CID 47035147
(1-((3-Propyl-1,2,4-oxadiazol-5-yl)methyl)piperidin-4-yl)methanol
CID 52234560
[1-[(3-Tert-butyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]methanol
CID 52274453

Frequently Asked Questions

What is the IUPAC name of [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol?
The IUPAC name of [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol (CID 70748958) is [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol.
What is the SMILES notation for [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol?
The canonical SMILES for [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol is CCCC1(CO)CCCN(Cc2nc(C)no2)C1.
What is the InChIKey of [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol?
The InChIKey is CLHHNCYFHYRWMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-3-5-13(10-17)6-4-7-16(9-13)8-12-14-11(2)15-18-12/h17H,3-10H2,1-2H3.
What are the key properties of [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol?
[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol has a molecular weight of 253.35 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-propylpiperidin-3-yl]methanol is sourced from PubChem (CID 70748958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).