4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide

C14H19N3O4 — CID 66248860

IUPAC4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide
SMILESCOc1ccc(C(N)=O)cc1NC(=O)C1(C)COCC1N
InChIInChI=1S/C14H19N3O4/c1-14(7-21-6-11(14)15)13(19)17-9-5-8(12(16)18)3-4-10(9)20-2/h3-5,11H,6-7,15H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyRSFZEFQXGQZPOT-UHFFFAOYSA-N
MW293.32 g/mol
LogP0.10
Rot. Bonds4

About 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide

4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide (PubChem CID 66248860) has the molecular formula C14H19N3O4 and a molecular weight of 293.32 g/mol. Its IUPAC name is 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide
PubChem CID66248860
Molecular FormulaC14H19N3O4
Molecular Weight293.32 g/mol
Exact Mass293.14
IUPAC Name4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide
SMILESCOc1ccc(C(N)=O)cc1NC(=O)C1(C)COCC1N
InChIInChI=1S/C14H19N3O4/c1-14(7-21-6-11(14)15)13(19)17-9-5-8(12(16)18)3-4-10(9)20-2/h3-5,11H,6-7,15H2,1-2H3,(H2,16,18)(H,17,19)
InChIKeyRSFZEFQXGQZPOT-UHFFFAOYSA-N
XLogP0.10
TPSA116.67 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 50.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide (CID 66248860) is 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide is COc1ccc(C(N)=O)cc1NC(=O)C1(C)COCC1N.
What is the InChIKey of 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide?
The InChIKey is RSFZEFQXGQZPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O4/c1-14(7-21-6-11(14)15)13(19)17-9-5-8(12(16)18)3-4-10(9)20-2/h3-5,11H,6-7,15H2,1-2H3,(H2,16,18)(H,17,19).
What are the key properties of 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide?
4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide has a molecular weight of 293.32 g/mol, XLogP of 0.10, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-carbamoyl-2-methoxyphenyl)-3-methyloxolane-3-carboxamide is sourced from PubChem (CID 66248860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).