5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide

C10H14N2O3 — CID 136525273

IUPAC5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)NCC1(C)COC1
InChIInChI=1S/C10H14N2O3/c1-7-8(12-6-15-7)9(13)11-3-10(2)4-14-5-10/h6H,3-5H2,1-2H3,(H,11,13)
InChIKeyAWFOSQKBZPOSCP-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.75
Rot. Bonds3

About 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide

5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide (PubChem CID 136525273) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide
PubChem CID136525273
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide
SMILESCc1ocnc1C(=O)NCC1(C)COC1
InChIInChI=1S/C10H14N2O3/c1-7-8(12-6-15-7)9(13)11-3-10(2)4-14-5-10/h6H,3-5H2,1-2H3,(H,11,13)
InChIKeyAWFOSQKBZPOSCP-UHFFFAOYSA-N
XLogP0.75
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[rel-(3R,4S)-1-(cyclobutylmethyl)-4-isopropyl-3-pyrrolidinyl]-5-methyl-1,3-oxazole-4-carboxamide hydrochloride
CID 72918063
tert-butyl N-((4-formyl-1,3-oxazol-5-yl)methyl)carbamate
CID 145874831
"2,5-dimethyl-N-(2-morpholinoethyl)-1,3-oxazole-4-carboxamide"
CID 53195158
2-{[(2,2-dimethylpropanoyl)amino]methyl}-N~4~,N~4~-diethyl-5-methyl-1,3-oxazole-4-carboxamide
CID 53195614
N-Cyclohexyl-N-[2-(dimethylamino)ethyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 74234028
Methyl 2-[(5-methyl-1,3-oxazole-4-carbonyl)amino]pentanoate
CID 75441942
5-methyl-N-({1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl}methyl)-1,3-oxazole-4-carboxamide
CID 118772730
5-methyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]-1,3-oxazole-4-carboxamide
CID 122556326
5-methyl-N-(1,1,1-trifluoro-2-hydroxypentan-3-yl)-1,3-oxazole-4-carboxamide
CID 132344982
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-5-(trifluoromethyl)-1,3-oxazole-4-carboxamide
CID 137978436
6-Oxa-1-azaspiro[3.3]heptan-1-yl-[5-(trifluoromethyl)-1,3-oxazol-4-yl]methanone
CID 138035908
N-(1-fluoroethyl)-2,5-dimethyl-1,3-oxazole-4-carboxamide
CID 134321109

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide (CID 136525273) is 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide is Cc1ocnc1C(=O)NCC1(C)COC1.
What is the InChIKey of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide?
The InChIKey is AWFOSQKBZPOSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-7-8(12-6-15-7)9(13)11-3-10(2)4-14-5-10/h6H,3-5H2,1-2H3,(H,11,13).
What are the key properties of 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide?
5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide has a molecular weight of 210.23 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 136525273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).