3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide

C11H15N3O3 — CID 64891921

IUPAC3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
SMILESCOc1ncccc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C11H15N3O3/c1-16-9-8(3-2-5-13-9)14-10(15)11(12)4-6-17-7-11/h2-3,5H,4,6-7,12H2,1H3,(H,14,15)
InChIKeyYLXXPEJRAIVCNZ-UHFFFAOYSA-N
MW237.26 g/mol
LogP0.15
Rot. Bonds3

About 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide

3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide (PubChem CID 64891921) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
PubChem CID64891921
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
SMILESCOc1ncccc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C11H15N3O3/c1-16-9-8(3-2-5-13-9)14-10(15)11(12)4-6-17-7-11/h2-3,5H,4,6-7,12H2,1H3,(H,14,15)
InChIKeyYLXXPEJRAIVCNZ-UHFFFAOYSA-N
XLogP0.15
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide (CID 64891921) is 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide is COc1ncccc1NC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide?
The InChIKey is YLXXPEJRAIVCNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-16-9-8(3-2-5-13-9)14-10(15)11(12)4-6-17-7-11/h2-3,5H,4,6-7,12H2,1H3,(H,14,15).
What are the key properties of 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide?
3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide has a molecular weight of 237.26 g/mol, XLogP of 0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide is sourced from PubChem (CID 64891921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).