3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide

C7H11N5O2 — CID 106113956

IUPAC3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide
SMILESCOC(CN)C(=O)Nc1nccnn1
InChIInChI=1S/C7H11N5O2/c1-14-5(4-8)6(13)11-7-9-2-3-10-12-7/h2-3,5H,4,8H2,1H3,(H,9,11,12,13)
InChIKeyJSZUBUQHDJBUIV-UHFFFAOYSA-N
MW197.20 g/mol
LogP-1.22
Rot. Bonds4

About 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide

3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide (PubChem CID 106113956) has the molecular formula C7H11N5O2 and a molecular weight of 197.20 g/mol. Its IUPAC name is 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide.

Molecular Properties

Compound Name3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide
PubChem CID106113956
Molecular FormulaC7H11N5O2
Molecular Weight197.20 g/mol
Exact Mass197.09
IUPAC Name3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide
SMILESCOC(CN)C(=O)Nc1nccnn1
InChIInChI=1S/C7H11N5O2/c1-14-5(4-8)6(13)11-7-9-2-3-10-12-7/h2-3,5H,4,8H2,1H3,(H,9,11,12,13)
InChIKeyJSZUBUQHDJBUIV-UHFFFAOYSA-N
XLogP-1.22
TPSA103.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-2-methyl-3-sulfanylidene-N-(1,2,4-triazin-3-yl)propanamide
CID 114388038
3-amino-N-(4-chloro-6-methoxypyrimidin-2-yl)-2-methoxypropanamide
CID 106114275
4-[(3-amino-2-methoxypropanoyl)amino]benzamide
CID 106111050
6-amino-2-methyl-N-(1,2,4-triazin-3-yl)heptanamide
CID 114387757
3-amino-N-(5-chloro-2-pyridinyl)-2-methoxypropanamide
CID 106111210
(2S)-2-amino-3-methyl-N-[2-oxo-2-(1,2,4-triazin-3-ylamino)ethyl]butanamide
CID 104919515
3-amino-N-(3,4-dimethoxyphenyl)-2-methoxypropanamide
CID 114144862
3-amino-4,4-dimethyl-N-(1,2,4-triazin-3-yl)pentanamide
CID 114387744
6-amino-4-ethyl-N-(1,2,4-triazin-3-yl)hexanamide
CID 114387822
3-amino-2-methoxy-N-[3-(triazol-1-yl)propyl]propanamide
CID 106113671
3-amino-2-methoxy-N-(3,4,5-trifluorophenyl)propanamide
CID 114145085
3-amino-N-(2-iodophenyl)-2-methoxypropanamide
CID 106111227

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide?
The IUPAC name of 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide (CID 106113956) is 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide.
What is the SMILES notation for 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide?
The canonical SMILES for 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide is COC(CN)C(=O)Nc1nccnn1.
What is the InChIKey of 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide?
The InChIKey is JSZUBUQHDJBUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5O2/c1-14-5(4-8)6(13)11-7-9-2-3-10-12-7/h2-3,5H,4,8H2,1H3,(H,9,11,12,13).
What are the key properties of 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide?
3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide has a molecular weight of 197.20 g/mol, XLogP of -1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methoxy-N-(1,2,4-triazin-3-yl)propanamide is sourced from PubChem (CID 106113956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).