[4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine

C11H19N3O — CID 114960967

IUPAC[4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine
SMILESCC1CCN(Cc2ccno2)CC1CN
InChIInChI=1S/C11H19N3O/c1-9-3-5-14(7-10(9)6-12)8-11-2-4-13-15-11/h2,4,9-10H,3,5-8,12H2,1H3
InChIKeyYPJDZODBYQTTKY-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.09
Rot. Bonds3

About [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine

[4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine (PubChem CID 114960967) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine
PubChem CID114960967
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine
SMILESCC1CCN(Cc2ccno2)CC1CN
InChIInChI=1S/C11H19N3O/c1-9-3-5-14(7-10(9)6-12)8-11-2-4-13-15-11/h2,4,9-10H,3,5-8,12H2,1H3
InChIKeyYPJDZODBYQTTKY-UHFFFAOYSA-N
XLogP1.09
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine 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-(1,2-oxazol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 71986555
N-ethyl-1-(1,2-oxazol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 71986627
5-[[4-(Trifluoromethyl)piperidin-1-yl]methyl]-1,2-oxazole
CID 71986501
(3S)-1-(1,2-oxazol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 95903173
(3R)-1-(1,2-oxazol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 95903174
(3R)-N-ethyl-1-(1,2-oxazol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 97585840
(3S)-N-ethyl-1-(1,2-oxazol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 97585841
N-(1,2-oxazol-5-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 103616141
N-(1,2-oxazol-5-ylmethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 104934265
N-(1,2-oxazol-5-ylmethyl)-3-(trifluoromethyl)cyclohexan-1-amine
CID 106415094
N-(1,2-oxazol-5-ylmethyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 106415508
cis-(1S,2R)-N-methyl-N-(1,2-oxazol-5-ylmethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 137984951

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine?
The IUPAC name of [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine (CID 114960967) is [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine.
What is the SMILES notation for [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine?
The canonical SMILES for [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine is CC1CCN(Cc2ccno2)CC1CN.
What is the InChIKey of [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine?
The InChIKey is YPJDZODBYQTTKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-3-5-14(7-10(9)6-12)8-11-2-4-13-15-11/h2,4,9-10H,3,5-8,12H2,1H3.
What are the key properties of [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine?
[4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine has a molecular weight of 209.29 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]methanamine is sourced from PubChem (CID 114960967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).