3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol

C9H15N3O2 — CID 114451732

IUPAC3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol
SMILESCc1nonc1CC1CNCCC1O
InChIInChI=1S/C9H15N3O2/c1-6-8(12-14-11-6)4-7-5-10-3-2-9(7)13/h7,9-10,13H,2-5H2,1H3
InChIKeyOZPSJTIKPDUKGN-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.11
Rot. Bonds2

About 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol

3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol (PubChem CID 114451732) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol
PubChem CID114451732
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol
SMILESCc1nonc1CC1CNCCC1O
InChIInChI=1S/C9H15N3O2/c1-6-8(12-14-11-6)4-7-5-10-3-2-9(7)13/h7,9-10,13H,2-5H2,1H3
InChIKeyOZPSJTIKPDUKGN-UHFFFAOYSA-N
XLogP-0.11
TPSA71.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2,6-dimethyl-4-pyridinyl)methyl]piperidin-4-ol
CID 146286067
3-[(5-methyl-3-pyridinyl)methyl]piperidin-4-ol
CID 102878520
3-[[4-(hydroxymethyl)phenyl]methyl]piperidin-4-ol
CID 114451747
3-[(5-bromothiophen-2-yl)methyl]piperidin-4-ol
CID 114451849
3-[(4-bromo-1,3-diethylpyrazol-5-yl)methyl]piperidin-4-ol
CID 114451911
(3R,4R)-3-(2-methylpropyl)piperidin-4-ol
CID 93495960
(3S,4S)-3-(2-methylpropyl)piperidin-4-ol
CID 93495959
3-[(4-tert-butyl-1,3-thiazol-2-yl)methyl]piperidin-4-ol
CID 114451769
(3S,4S)-3-(cyclopropylmethyl)piperidin-4-ol
CID 129393768
ethane;3-(2-methylpropyl)piperidin-4-ol
CID 143575873
N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]azetidine-3-carboxamide
CID 130762934
3-[(3-bromothiophen-2-yl)methyl]piperidin-4-ol
CID 114451957

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol?
The IUPAC name of 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol (CID 114451732) is 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol.
What is the SMILES notation for 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol?
The canonical SMILES for 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol is Cc1nonc1CC1CNCCC1O.
What is the InChIKey of 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol?
The InChIKey is OZPSJTIKPDUKGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-6-8(12-14-11-6)4-7-5-10-3-2-9(7)13/h7,9-10,13H,2-5H2,1H3.
What are the key properties of 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol?
3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol has a molecular weight of 197.24 g/mol, XLogP of -0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]piperidin-4-ol is sourced from PubChem (CID 114451732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).