(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone

C19H28N4O2 — CID 91923930

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone
SMILESCCCn1c(C)cnc1CC1CCN(C(=O)c2c(C)noc2C)CC1
InChIInChI=1S/C19H28N4O2/c1-5-8-23-13(2)12-20-17(23)11-16-6-9-22(10-7-16)19(24)18-14(3)21-25-15(18)4/h12,16H,5-11H2,1-4H3
InChIKeyQGDHSROWSHAJGK-UHFFFAOYSA-N
MW344.46 g/mol
LogP3.30
Rot. Bonds5

About (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone

(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone (PubChem CID 91923930) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone
PubChem CID91923930
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone
SMILESCCCn1c(C)cnc1CC1CCN(C(=O)c2c(C)noc2C)CC1
InChIInChI=1S/C19H28N4O2/c1-5-8-23-13(2)12-20-17(23)11-16-6-9-22(10-7-16)19(24)18-14(3)21-25-15(18)4/h12,16H,5-11H2,1-4H3
InChIKeyQGDHSROWSHAJGK-UHFFFAOYSA-N
XLogP3.30
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone with MolForge

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Related Compounds

4-(4-Imidazol-1-ylpyrimidin-2-yl)-3,5-dimethyl-1,2-oxazole
CID 3234277
(3,5-Dimethyl-1,2-oxazol-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 1247460
(3,5-Dimethyl-1,2-oxazol-4-yl)-(9-pyrimidin-2-yl-3,9-diazaspiro[5.5]undecan-3-yl)methanone
CID 3234526
(3,5-Dimethyl-1,2-oxazol-4-yl)-(2-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonan-7-yl)methanone
CID 3235238
(3,5-dimethyl-1,2-oxazol-4-yl)-[(5S)-2-pyrimidin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone
CID 3235315
(3-Ethyl-5-methyl-1,2-oxazol-4-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 33112388
3,5-Dimethyl-4-[[3-methyl-4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methyl]-1,2-oxazole
CID 53566665
3,5-Dimethyl-4-[[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methyl]-1,2-oxazole
CID 53577382
(3,5-Dimethyl-1,2-oxazol-4-yl)-[4-[(1-propan-2-ylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone
CID 53612086
2-(3,5-Dimethyl-1,2-oxazol-4-yl)-1-[3-(2-methylimidazol-1-yl)piperidin-1-yl]ethanone
CID 53617722
1-[(3,5-dimethyl-4-isoxazolyl)acetyl]-3-[(2-methyl-1H-imidazol-1-yl)methyl]piperidine
CID 70730701
1-[(3,5-dimethyl-4-isoxazolyl)carbonyl]-3-[1-(1,3-thiazol-4-ylmethyl)-1H-imidazol-2-yl]piperidine
CID 72886855

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone (CID 91923930) is (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone is CCCn1c(C)cnc1CC1CCN(C(=O)c2c(C)noc2C)CC1.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone?
The InChIKey is QGDHSROWSHAJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-5-8-23-13(2)12-20-17(23)11-16-6-9-22(10-7-16)19(24)18-14(3)21-25-15(18)4/h12,16H,5-11H2,1-4H3.
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone?
(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone has a molecular weight of 344.46 g/mol, XLogP of 3.30, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(5-methyl-1-propylimidazol-2-yl)methyl]piperidin-1-yl]methanone is sourced from PubChem (CID 91923930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).