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

C12H17N3O3 — CID 64893957

IUPAC3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide
SMILESCCOc1ncccc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C12H17N3O3/c1-2-18-10-9(4-3-6-14-10)15-11(16)12(13)5-7-17-8-12/h3-4,6H,2,5,7-8,13H2,1H3,(H,15,16)
InChIKeyYWQNKKVSYFDSRB-UHFFFAOYSA-N
MW251.29 g/mol
LogP0.54
Rot. Bonds4

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

3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide (PubChem CID 64893957) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide
PubChem CID64893957
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC Name3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide
SMILESCCOc1ncccc1NC(=O)C1(N)CCOC1
InChIInChI=1S/C12H17N3O3/c1-2-18-10-9(4-3-6-14-10)15-11(16)12(13)5-7-17-8-12/h3-4,6H,2,5,7-8,13H2,1H3,(H,15,16)
InChIKeyYWQNKKVSYFDSRB-UHFFFAOYSA-N
XLogP0.54
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide
CID 115293923
3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64891921
1-amino-N-(2-ethoxy-3-pyridinyl)cyclopropane-1-carboxamide
CID 65467015
3-amino-N-[2-(ethoxymethyl)phenyl]oxolane-3-carboxamide
CID 64891108
3-amino-N-(3,4-diethoxyphenyl)oxolane-3-carboxamide
CID 64892076
4-amino-N-(2-chloro-3-pyridinyl)oxane-4-carboxamide
CID 113280621
3-amino-N-(3-ethoxy-4-methoxyphenyl)oxolane-3-carboxamide
CID 64892534
3-amino-N-[2-(pyrazol-1-ylmethyl)phenyl]oxolane-3-carboxamide
CID 64892317
3-amino-N-[2-[(dimethylamino)methyl]phenyl]oxolane-3-carboxamide
CID 64891107
N-(2-ethoxy-3-pyridinyl)-3-ethylpiperidine-3-carboxamide
CID 63130921
2-amino-N-(2-ethoxy-3-pyridinyl)-2-ethylbutanamide
CID 79809690
3-amino-N-(3-bromo-2-hydroxyphenyl)oxolane-3-carboxamide
CID 81499886

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide (CID 64893957) is 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide is CCOc1ncccc1NC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide?
The InChIKey is YWQNKKVSYFDSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c1-2-18-10-9(4-3-6-14-10)15-11(16)12(13)5-7-17-8-12/h3-4,6H,2,5,7-8,13H2,1H3,(H,15,16).
What are the key properties of 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide?
3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide has a molecular weight of 251.29 g/mol, XLogP of 0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide is sourced from PubChem (CID 64893957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).