5-cyclopropyl-1-methyltriazol-4-amine

C6H10N4 — CID 79547588

IUPAC5-cyclopropyl-1-methyltriazol-4-amine
SMILESCn1nnc(N)c1C1CC1
InChIInChI=1S/C6H10N4/c1-10-5(4-2-3-4)6(7)8-9-10/h4H,2-3,7H2,1H3
InChIKeyDMSNCRGCPSDDCP-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.27
Rot. Bonds1

About 5-cyclopropyl-1-methyltriazol-4-amine

5-cyclopropyl-1-methyltriazol-4-amine (PubChem CID 79547588) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 5-cyclopropyl-1-methyltriazol-4-amine.

Molecular Properties

Compound Name5-cyclopropyl-1-methyltriazol-4-amine
PubChem CID79547588
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name5-cyclopropyl-1-methyltriazol-4-amine
SMILESCn1nnc(N)c1C1CC1
InChIInChI=1S/C6H10N4/c1-10-5(4-2-3-4)6(7)8-9-10/h4H,2-3,7H2,1H3
InChIKeyDMSNCRGCPSDDCP-UHFFFAOYSA-N
XLogP0.27
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-methyltriazol-4-amine?
The IUPAC name of 5-cyclopropyl-1-methyltriazol-4-amine (CID 79547588) is 5-cyclopropyl-1-methyltriazol-4-amine.
What is the SMILES notation for 5-cyclopropyl-1-methyltriazol-4-amine?
The canonical SMILES for 5-cyclopropyl-1-methyltriazol-4-amine is Cn1nnc(N)c1C1CC1.
What is the InChIKey of 5-cyclopropyl-1-methyltriazol-4-amine?
The InChIKey is DMSNCRGCPSDDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4/c1-10-5(4-2-3-4)6(7)8-9-10/h4H,2-3,7H2,1H3.
What are the key properties of 5-cyclopropyl-1-methyltriazol-4-amine?
5-cyclopropyl-1-methyltriazol-4-amine has a molecular weight of 138.17 g/mol, XLogP of 0.27, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-methyltriazol-4-amine is sourced from PubChem (CID 79547588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).