4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid

C14H20N2O5 — CID 43360625

IUPAC4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid
SMILESCc1cc(OCC(=O)NC2(C(=O)O)CCC(C)CC2)no1
InChIInChI=1S/C14H20N2O5/c1-9-3-5-14(6-4-9,13(18)19)15-11(17)8-20-12-7-10(2)21-16-12/h7,9H,3-6,8H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyMFOYFTRTFGWCHB-UHFFFAOYSA-N
MW296.32 g/mol
LogP1.51
Rot. Bonds5

About 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid

4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid (PubChem CID 43360625) has the molecular formula C14H20N2O5 and a molecular weight of 296.32 g/mol. Its IUPAC name is 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid
PubChem CID43360625
Molecular FormulaC14H20N2O5
Molecular Weight296.32 g/mol
Exact Mass296.14
IUPAC Name4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid
SMILESCc1cc(OCC(=O)NC2(C(=O)O)CCC(C)CC2)no1
InChIInChI=1S/C14H20N2O5/c1-9-3-5-14(6-4-9,13(18)19)15-11(17)8-20-12-7-10(2)21-16-12/h7,9H,3-6,8H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyMFOYFTRTFGWCHB-UHFFFAOYSA-N
XLogP1.51
TPSA101.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

Methyl 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylate
CID 30373144
[2-[(1-Cyanocyclohexyl)amino]-2-oxoethyl] 2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetate
CID 8376583
4-Methyl-2-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]pentanoic acid
CID 43170183
3-Methyl-2-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]pentanoic acid
CID 43171242
1-[[2-[(5-Methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid
CID 43350938
1-[[2-[(5-Methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid
CID 43351058
6-[[2-[(5-Methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]hexanoic acid
CID 43352991
3-Methyl-2-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]butanoic acid
CID 43354107
7-[[2-[(5-Methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]heptanoic acid
CID 43359027
2-Cyclopropyl-2-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]propanoic acid
CID 43360552
1-[[2-[(5-Methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cycloheptane-1-carboxylic acid
CID 43360712
Methyl 4-methyl-2-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]pentanoate
CID 43408782

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid?
The IUPAC name of 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid (CID 43360625) is 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid.
What is the SMILES notation for 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid?
The canonical SMILES for 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid is Cc1cc(OCC(=O)NC2(C(=O)O)CCC(C)CC2)no1.
What is the InChIKey of 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid?
The InChIKey is MFOYFTRTFGWCHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5/c1-9-3-5-14(6-4-9,13(18)19)15-11(17)8-20-12-7-10(2)21-16-12/h7,9H,3-6,8H2,1-2H3,(H,15,17)(H,18,19).
What are the key properties of 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid?
4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid has a molecular weight of 296.32 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclohexane-1-carboxylic acid is sourced from PubChem (CID 43360625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).