5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide

C11H14N2O2 — CID 25237561

IUPAC5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide
SMILESC=CCN(CC=C)C(=O)c1cc(C)on1
InChIInChI=1S/C11H14N2O2/c1-4-6-13(7-5-2)11(14)10-8-9(3)15-12-10/h4-5,8H,1-2,6-7H2,3H3
InChIKeyJBNMENGIBYUGDS-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.80
Rot. Bonds5

About 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide

5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide (PubChem CID 25237561) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide
PubChem CID25237561
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide
SMILESC=CCN(CC=C)C(=O)c1cc(C)on1
InChIInChI=1S/C11H14N2O2/c1-4-6-13(7-5-2)11(14)10-8-9(3)15-12-10/h4-5,8H,1-2,6-7H2,3H3
InChIKeyJBNMENGIBYUGDS-UHFFFAOYSA-N
XLogP1.80
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(5-methyl-1,2-oxazole-3-carbonyl)-N,N-bis(prop-2-enyl)azetidine-3-carboxamide
CID 90511554
N-(2-bromoethyl)-N-ethyl-5-methyl-1,2-oxazole-3-carboxamide
CID 80660169
3-[acetyl(prop-2-enyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 113115709
N-ethyl-N,5-dimethyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 130615848
N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-prop-2-enylbutanamide
CID 4616353
2,2-dichloro-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-prop-2-enylacetamide
CID 42770232
2-[(5-cyclopropyl-1,2-oxazole-3-carbonyl)-prop-2-enylamino]acetic acid
CID 79264559
1-N,1-N,3-N,3-N,5-N,5-N-hexakis(prop-2-enyl)benzene-1,3,5-tricarboxamide
CID 54167300
N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-prop-2-enylfuran-2-carboxamide
CID 42770234
2-[cyclopropylmethyl-(5-methyl-1,2-oxazole-3-carbonyl)amino]acetic acid
CID 43655885
N-ethyl-5-methyl-N-(piperidin-4-ylmethyl)-1,2-oxazole-3-carboxamide
CID 79720535
N-methoxy-N,5-dimethyl-1,2-oxazole-3-carboxamide
CID 45099367

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide (CID 25237561) is 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide is C=CCN(CC=C)C(=O)c1cc(C)on1.
What is the InChIKey of 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide?
The InChIKey is JBNMENGIBYUGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-4-6-13(7-5-2)11(14)10-8-9(3)15-12-10/h4-5,8H,1-2,6-7H2,3H3.
What are the key properties of 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide?
5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide has a molecular weight of 206.24 g/mol, XLogP of 1.80, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N,N-bis(prop-2-enyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 25237561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).