N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide

C15H18N4O4 — CID 129433026

IUPACN-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide
SMILESC[C@@H]1CCCN(C(=O)c2ccon2)[C@H]1CNC(=O)c1ccon1
InChIInChI=1S/C15H18N4O4/c1-10-3-2-6-19(15(21)12-5-8-23-18-12)13(10)9-16-14(20)11-4-7-22-17-11/h4-5,7-8,10,13H,2-3,6,9H2,1H3,(H,16,20)/t10-,13+/m1/s1
InChIKeyHXQUULOCAQMVJO-MFKMUULPSA-N
MW318.33 g/mol
LogP1.33
Rot. Bonds4

About N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide

N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide (PubChem CID 129433026) has the molecular formula C15H18N4O4 and a molecular weight of 318.33 g/mol. Its IUPAC name is N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide
PubChem CID129433026
Molecular FormulaC15H18N4O4
Molecular Weight318.33 g/mol
Exact Mass318.13
IUPAC NameN-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide
SMILESC[C@@H]1CCCN(C(=O)c2ccon2)[C@H]1CNC(=O)c1ccon1
InChIInChI=1S/C15H18N4O4/c1-10-3-2-6-19(15(21)12-5-8-23-18-12)13(10)9-16-14(20)11-4-7-22-17-11/h4-5,7-8,10,13H,2-3,6,9H2,1H3,(H,16,20)/t10-,13+/m1/s1
InChIKeyHXQUULOCAQMVJO-MFKMUULPSA-N
XLogP1.33
TPSA101.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.33
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide with MolForge

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Related Compounds

N-[[(2R,3S)-1-methyl-2-(2-methylpyrazol-3-yl)piperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide
CID 128989331
[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]-(1,2-oxazol-3-yl)methanone
CID 79543848
[2-(2,5-dimethylphenyl)pyrrolidin-1-yl]-(1,2-oxazol-3-yl)methanone
CID 71917445
(2S)-1-(1,2-oxazole-3-carbonyl)piperidine-2-carboxylic acid
CID 66263273
N-[[(2R,3S)-1-methyl-2-(3-methylimidazol-4-yl)piperidin-3-yl]methyl]-1,2-oxazole-3-carboxamide
CID 128989664
N-[[1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-4-yl]methyl]-1,2-oxazole-3-carboxamide
CID 56738478
N-[2-hydroxy-3-(4-methylpiperidin-1-yl)propyl]-1,2-oxazole-3-carboxamide
CID 111422396
N-[(3,3-difluorocyclobutyl)methyl]-1,2-oxazole-3-carboxamide
CID 126767362
[2-(2-bromoethyl)piperidin-1-yl]-(1,2-oxazol-3-yl)methanone
CID 80666279
[4-(methylaminomethyl)piperidin-1-yl]-(1,2-oxazol-3-yl)methanone;hydrochloride
CID 119543358
(2-methylpiperazin-1-yl)-(1,2-oxazol-3-yl)methanone
CID 62671508
N-(3-methylbutyl)-1,2-oxazole-3-carboxamide
CID 110693766

Frequently Asked Questions

What is the IUPAC name of N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide (CID 129433026) is N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide is C[C@@H]1CCCN(C(=O)c2ccon2)[C@H]1CNC(=O)c1ccon1.
What is the InChIKey of N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide?
The InChIKey is HXQUULOCAQMVJO-MFKMUULPSA-N. The full InChI is InChI=1S/C15H18N4O4/c1-10-3-2-6-19(15(21)12-5-8-23-18-12)13(10)9-16-14(20)11-4-7-22-17-11/h4-5,7-8,10,13H,2-3,6,9H2,1H3,(H,16,20)/t10-,13+/m1/s1.
What are the key properties of N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide?
N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide has a molecular weight of 318.33 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R,3R)-3-methyl-1-(1,2-oxazole-3-carbonyl)piperidin-2-yl]methyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 129433026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).