2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid

C14H15N3O4 — CID 107339195

IUPAC2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid
SMILESCCc1noc(C)c1C(=O)Nc1ccc(CC(=O)O)nc1
InChIInChI=1S/C14H15N3O4/c1-3-11-13(8(2)21-17-11)14(20)16-10-5-4-9(15-7-10)6-12(18)19/h4-5,7H,3,6H2,1-2H3,(H,16,20)(H,18,19)
InChIKeyZSRDDRZHHOINJN-UHFFFAOYSA-N
MW289.29 g/mol
LogP1.82
Rot. Bonds5

About 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid

2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid (PubChem CID 107339195) has the molecular formula C14H15N3O4 and a molecular weight of 289.29 g/mol. Its IUPAC name is 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid.

Molecular Properties

Compound Name2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid
PubChem CID107339195
Molecular FormulaC14H15N3O4
Molecular Weight289.29 g/mol
Exact Mass289.11
IUPAC Name2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid
SMILESCCc1noc(C)c1C(=O)Nc1ccc(CC(=O)O)nc1
InChIInChI=1S/C14H15N3O4/c1-3-11-13(8(2)21-17-11)14(20)16-10-5-4-9(15-7-10)6-12(18)19/h4-5,7H,3,6H2,1-2H3,(H,16,20)(H,18,19)
InChIKeyZSRDDRZHHOINJN-UHFFFAOYSA-N
XLogP1.82
TPSA105.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.29
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

3-ethyl-N-(4-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 9040097
3-ethyl-5-methyl-N-[4-[(5-methyl-1,2-oxazole-4-carbonyl)amino]phenyl]-1,2-oxazole-4-carboxamide
CID 51125656
3-ethyl-5-methyl-N-[4-(methylcarbamoyl)phenyl]-1,2-oxazole-4-carboxamide
CID 9158633
N-(3-chloro-4-methylphenyl)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 9068463
2-[5-[(2,5-dimethylfuran-3-carbonyl)amino]-2-pyridinyl]acetic acid
CID 107338349
N-(2,6-diethylphenyl)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 17173863
2-[5-(ethoxycarbonylamino)-2-pyridinyl]acetic acid
CID 107339556
N-[4-(4-bromophenyl)sulfanylphenyl]-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 18274326
2-[5-(dimethylcarbamoylamino)-2-pyridinyl]acetic acid
CID 107339518
3-ethyl-N-[4-[ethyl(propan-2-yl)amino]phenyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 30790659
3-ethyl-5-methyl-N-(4-methyl-3-nitrophenyl)-1,2-oxazole-4-carboxamide
CID 29201390
2-[5-[(4-chloro-3-methylbenzoyl)amino]-2-pyridinyl]acetic acid
CID 107339418

Frequently Asked Questions

What is the IUPAC name of 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid?
The IUPAC name of 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid (CID 107339195) is 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid.
What is the SMILES notation for 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid?
The canonical SMILES for 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid is CCc1noc(C)c1C(=O)Nc1ccc(CC(=O)O)nc1.
What is the InChIKey of 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid?
The InChIKey is ZSRDDRZHHOINJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O4/c1-3-11-13(8(2)21-17-11)14(20)16-10-5-4-9(15-7-10)6-12(18)19/h4-5,7H,3,6H2,1-2H3,(H,16,20)(H,18,19).
What are the key properties of 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid?
2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid has a molecular weight of 289.29 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-2-pyridinyl]acetic acid is sourced from PubChem (CID 107339195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).