3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine

C12H17N5O — CID 133477972

IUPAC3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
SMILESCOCC(C)Nc1nccn2c(C3CC3)nnc12
InChIInChI=1S/C12H17N5O/c1-8(7-18-2)14-10-12-16-15-11(9-3-4-9)17(12)6-5-13-10/h5-6,8-9H,3-4,7H2,1-2H3,(H,13,14)
InChIKeyMWLJKTKWBOOYGU-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.45
Rot. Bonds5

About 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine

3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine (PubChem CID 133477972) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
PubChem CID133477972
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC Name3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
SMILESCOCC(C)Nc1nccn2c(C3CC3)nnc12
InChIInChI=1S/C12H17N5O/c1-8(7-18-2)14-10-12-16-15-11(9-3-4-9)17(12)6-5-13-10/h5-6,8-9H,3-4,7H2,1-2H3,(H,13,14)
InChIKeyMWLJKTKWBOOYGU-UHFFFAOYSA-N
XLogP1.45
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine with MolForge

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Related Compounds

3-cyclopropyl-N-[1-(4-methylsulfonylphenyl)ethyl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 133478606
3-cyclopropyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 91651037
3-cyclopropyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 133478223
2-[(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]-1-phenylethanol
CID 133477982
3-cyclopropyl-N-[3-(2-methylpiperidin-1-yl)propyl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 133478440
3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 84655220
N-(1-chloropropan-2-yl)-3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 65029623
(2R)-1-[4-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl]propan-2-ol
CID 133499653
1-cyclohexyl-N-(1-methoxypropan-2-yl)imidazol-2-amine
CID 106554635
N-(1-methoxypropan-2-yl)-1-(thiolan-3-yl)imidazol-2-amine
CID 106583133
4-methoxy-3-[(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]butan-1-ol
CID 106157669
N-(1-methoxypropan-2-yl)-1-(1-oxothian-4-yl)imidazol-2-amine
CID 106580407

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The IUPAC name of 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine (CID 133477972) is 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine.
What is the SMILES notation for 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The canonical SMILES for 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine is COCC(C)Nc1nccn2c(C3CC3)nnc12.
What is the InChIKey of 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The InChIKey is MWLJKTKWBOOYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c1-8(7-18-2)14-10-12-16-15-11(9-3-4-9)17(12)6-5-13-10/h5-6,8-9H,3-4,7H2,1-2H3,(H,13,14).
What are the key properties of 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine has a molecular weight of 247.30 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(1-methoxypropan-2-yl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine is sourced from PubChem (CID 133477972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).