3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one

C13H18N4O2 — CID 134795263

IUPAC3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one
SMILESCc1cc(CN2CCC(n3cc[nH]c3=O)CC2)no1
InChIInChI=1S/C13H18N4O2/c1-10-8-11(15-19-10)9-16-5-2-12(3-6-16)17-7-4-14-13(17)18/h4,7-8,12H,2-3,5-6,9H2,1H3,(H,14,18)
InChIKeyPOMOVWIFTSFHNS-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.31
Rot. Bonds3

About 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one

3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one (PubChem CID 134795263) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one.

Molecular Properties

Compound Name3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one
PubChem CID134795263
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one
SMILESCc1cc(CN2CCC(n3cc[nH]c3=O)CC2)no1
InChIInChI=1S/C13H18N4O2/c1-10-8-11(15-19-10)9-16-5-2-12(3-6-16)17-7-4-14-13(17)18/h4,7-8,12H,2-3,5-6,9H2,1H3,(H,14,18)
InChIKeyPOMOVWIFTSFHNS-UHFFFAOYSA-N
XLogP1.31
TPSA67.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one 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

5-Methyl-N-(piperidin-4-yl)-1,2-oxazole-3-carboxamide
CID 43345754
3-methyl-5-[[(2E)-2-(nitromethylidene)imidazolidin-1-yl]methyl]-1,2-oxazole
CID 14009815
(2S)-2-[3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,6-dioxo-5H-purin-7-ium-7-yl]propanamide
CID 139269299
2-[3-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,6-dioxo-5H-purin-7-ium-7-yl]acetamide
CID 139269484
Isoxazole, 5-methyl-3-(piperidinomethyl)-, hydrochloride
CID 13673
3-Cyclopentyl-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 38236095
1-Methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-(1-methylsulfonylpiperidin-4-yl)urea
CID 45830997
4-[(3-methyl-1,2-oxazol-5-yl)methyl]-N-propylpiperazine-1-carboxamide
CID 47125438
3-(4-Hydroxycyclohexyl)-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 47239276
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboxamide
CID 47862381
3-(1-Cyclopropylpiperidin-4-yl)-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 51084123
N-methyl-2-[4-[[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]carbamoyl]amino]piperidin-1-yl]acetamide
CID 53498056

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one?
The IUPAC name of 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one (CID 134795263) is 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one.
What is the SMILES notation for 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one?
The canonical SMILES for 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one is Cc1cc(CN2CCC(n3cc[nH]c3=O)CC2)no1.
What is the InChIKey of 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one?
The InChIKey is POMOVWIFTSFHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-10-8-11(15-19-10)9-16-5-2-12(3-6-16)17-7-4-14-13(17)18/h4,7-8,12H,2-3,5-6,9H2,1H3,(H,14,18).
What are the key properties of 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one?
3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one has a molecular weight of 262.31 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-imidazol-2-one is sourced from PubChem (CID 134795263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).