(2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide

C19H20N4O3 — CID 125179035

IUPAC(2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide
SMILESCc1cc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3cnco3)c2)no1
InChIInChI=1S/C19H20N4O3/c1-13-9-16(22-26-13)17-7-2-3-8-23(17)19(24)21-15-6-4-5-14(10-15)18-11-20-12-25-18/h4-6,9-12,17H,2-3,7-8H2,1H3,(H,21,24)/t17-/m0/s1
InChIKeyYVHGSTBXWGHYSE-KRWDZBQOSA-N
MW352.39 g/mol
LogP4.40
Rot. Bonds3

About (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide

(2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide (PubChem CID 125179035) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name(2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide
PubChem CID125179035
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name(2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide
SMILESCc1cc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3cnco3)c2)no1
InChIInChI=1S/C19H20N4O3/c1-13-9-16(22-26-13)17-7-2-3-8-23(17)19(24)21-15-6-4-5-14(10-15)18-11-20-12-25-18/h4-6,9-12,17H,2-3,7-8H2,1H3,(H,21,24)/t17-/m0/s1
InChIKeyYVHGSTBXWGHYSE-KRWDZBQOSA-N
XLogP4.40
TPSA84.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide with MolForge

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Related Compounds

2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide
CID 118789446
(2S)-2-[2-(2-methylimidazol-1-yl)ethyl]-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide
CID 97281863
N-(1,3-benzodioxol-5-yl)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 50946008
N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 74241052
2-(5-methyl-1,2-oxazol-3-yl)-N-(1-methyl-3-pyridin-3-ylpyrazol-5-yl)pyrrolidine-1-carboxamide
CID 118779738
(2S)-N-(4-fluorophenyl)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 94035214
(2R)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]pyrrolidine-1-carboxamide
CID 95157820
(2R)-1-(cyclohexanecarbonyl)-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrolidine-2-carboxamide
CID 95350172
1-cyclohexyl-1-methyl-3-[3-(1,3-oxazol-5-yl)phenyl]urea
CID 72886720
2-(5-methyl-1,2-oxazol-3-yl)-N-(4-methyl-2-oxochromen-7-yl)piperidine-1-carboxamide
CID 118784987
cyclopentyl-[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 53017082
cyclohexyl-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]methanone
CID 94002506

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide?
The IUPAC name of (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide (CID 125179035) is (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide.
What is the SMILES notation for (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide?
The canonical SMILES for (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide is Cc1cc([C@@H]2CCCCN2C(=O)Nc2cccc(-c3cnco3)c2)no1.
What is the InChIKey of (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide?
The InChIKey is YVHGSTBXWGHYSE-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-13-9-16(22-26-13)17-7-2-3-8-23(17)19(24)21-15-6-4-5-14(10-15)18-11-20-12-25-18/h4-6,9-12,17H,2-3,7-8H2,1H3,(H,21,24)/t17-/m0/s1.
What are the key properties of (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide?
(2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 4.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-[3-(1,3-oxazol-5-yl)phenyl]piperidine-1-carboxamide is sourced from PubChem (CID 125179035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).