4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide

C14H20N2O3 — CID 66239016

IUPAC4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide
SMILESCOc1c(C)ccc(NC(=O)C2COCC2N)c1C
InChIInChI=1S/C14H20N2O3/c1-8-4-5-12(9(2)13(8)18-3)16-14(17)10-6-19-7-11(10)15/h4-5,10-11H,6-7,15H2,1-3H3,(H,16,17)
InChIKeyOGTCXELIUJSPGR-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.22
Rot. Bonds3

About 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide

4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide (PubChem CID 66239016) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide
PubChem CID66239016
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide
SMILESCOc1c(C)ccc(NC(=O)C2COCC2N)c1C
InChIInChI=1S/C14H20N2O3/c1-8-4-5-12(9(2)13(8)18-3)16-14(17)10-6-19-7-11(10)15/h4-5,10-11H,6-7,15H2,1-3H3,(H,16,17)
InChIKeyOGTCXELIUJSPGR-UHFFFAOYSA-N
XLogP1.22
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2,3-dimethylphenyl)oxolane-3-carboxamide
CID 66240994
4-amino-N-(5-bromo-2-methylphenyl)oxolane-3-carboxamide
CID 66238442
methyl 2-[(4-aminooxolane-3-carbonyl)amino]-5-methylbenzoate
CID 66240421
4-amino-N-[2-methyl-5-(propanoylamino)phenyl]oxolane-3-carboxamide
CID 66239629
4-amino-N-(2-chloro-3-methylphenyl)oxolane-3-carboxamide
CID 114252127
4-amino-N-(2-bromo-5-methoxyphenyl)oxolane-3-carboxamide
CID 66235288
4-amino-N-(2-methyl-4-nitrophenyl)oxolane-3-carboxamide
CID 66240231
4-amino-N-(3-iodo-4-methylphenyl)oxolane-3-carboxamide
CID 66239031
4-amino-N-(2-methylsulfonylphenyl)oxolane-3-carboxamide
CID 66239441
4-amino-N-[5-(ethylcarbamoyl)-2-methylphenyl]oxolane-3-carboxamide
CID 66240837
2-(2-chlorophenyl)-N-(3-methoxy-2,4-dimethylphenyl)cyclopropane-1-carboxamide
CID 112819613
(2R)-N-(3-methoxy-2,4-dimethylphenyl)pyrrolidine-2-carboxamide
CID 113263992

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide (CID 66239016) is 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide is COc1c(C)ccc(NC(=O)C2COCC2N)c1C.
What is the InChIKey of 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide?
The InChIKey is OGTCXELIUJSPGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-8-4-5-12(9(2)13(8)18-3)16-14(17)10-6-19-7-11(10)15/h4-5,10-11H,6-7,15H2,1-3H3,(H,16,17).
What are the key properties of 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide?
4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-methoxy-2,4-dimethylphenyl)oxolane-3-carboxamide is sourced from PubChem (CID 66239016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).