3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide

C8H11N5O2 — CID 114387755

IUPAC3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide
SMILESNC1(C(=O)Nc2nccnn2)CCOC1
InChIInChI=1S/C8H11N5O2/c9-8(1-4-15-5-8)6(14)12-7-10-2-3-11-13-7/h2-3H,1,4-5,9H2,(H,10,12,13,14)
InChIKeyMFXJODPUWRCITI-UHFFFAOYSA-N
MW209.21 g/mol
LogP-1.07
Rot. Bonds2

About 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide

3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide (PubChem CID 114387755) has the molecular formula C8H11N5O2 and a molecular weight of 209.21 g/mol. Its IUPAC name is 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide
PubChem CID114387755
Molecular FormulaC8H11N5O2
Molecular Weight209.21 g/mol
Exact Mass209.09
IUPAC Name3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide
SMILESNC1(C(=O)Nc2nccnn2)CCOC1
InChIInChI=1S/C8H11N5O2/c9-8(1-4-15-5-8)6(14)12-7-10-2-3-11-13-7/h2-3H,1,4-5,9H2,(H,10,12,13,14)
InChIKeyMFXJODPUWRCITI-UHFFFAOYSA-N
XLogP-1.07
TPSA103.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-N-pyrimidin-2-yloxane-4-carboxamide
CID 115293590
3-amino-N-(4-carbamoylphenyl)oxolane-3-carboxamide
CID 64891880
3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64891921
3-amino-N-(3-fluoro-4-pyridinyl)oxolane-3-carboxamide
CID 107594990
3-amino-N-(5-methyl-1,2-oxazol-3-yl)oxolane-3-carboxamide
CID 64893505
3-amino-N-[2-(triazol-1-yl)phenyl]oxolane-3-carboxamide
CID 64893121
3-amino-N-[4-(tetrazol-1-yl)phenyl]oxolane-3-carboxamide
CID 64892992
3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64893957
3-amino-N-[4-(2-amino-2-oxoethoxy)phenyl]oxolane-3-carboxamide
CID 64891525
1-cyano-N-(1,2,4-triazin-3-yl)cyclobutane-1-carboxamide
CID 114387955
3-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)oxolane-3-carboxamide
CID 104618529
3-amino-N-[6-(trifluoromethyl)-3-pyridinyl]oxolane-3-carboxamide
CID 82817640

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide (CID 114387755) is 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide is NC1(C(=O)Nc2nccnn2)CCOC1.
What is the InChIKey of 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide?
The InChIKey is MFXJODPUWRCITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O2/c9-8(1-4-15-5-8)6(14)12-7-10-2-3-11-13-7/h2-3H,1,4-5,9H2,(H,10,12,13,14).
What are the key properties of 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide?
3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide has a molecular weight of 209.21 g/mol, XLogP of -1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1,2,4-triazin-3-yl)oxolane-3-carboxamide is sourced from PubChem (CID 114387755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).