1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine

C10H16N4 — CID 79547670

IUPAC1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine
SMILESNc1nnn(CC2CCC2)c1C1CC1
InChIInChI=1S/C10H16N4/c11-10-9(8-4-5-8)14(13-12-10)6-7-2-1-3-7/h7-8H,1-6,11H2
InChIKeyQKYCPBJHFRAIDZ-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.54
Rot. Bonds3

About 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine

1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine (PubChem CID 79547670) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine
PubChem CID79547670
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine
SMILESNc1nnn(CC2CCC2)c1C1CC1
InChIInChI=1S/C10H16N4/c11-10-9(8-4-5-8)14(13-12-10)6-7-2-1-3-7/h7-8H,1-6,11H2
InChIKeyQKYCPBJHFRAIDZ-UHFFFAOYSA-N
XLogP1.54
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine?
The IUPAC name of 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine (CID 79547670) is 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine.
What is the SMILES notation for 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine?
The canonical SMILES for 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine is Nc1nnn(CC2CCC2)c1C1CC1.
What is the InChIKey of 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine?
The InChIKey is QKYCPBJHFRAIDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c11-10-9(8-4-5-8)14(13-12-10)6-7-2-1-3-7/h7-8H,1-6,11H2.
What are the key properties of 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine?
1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine has a molecular weight of 192.27 g/mol, XLogP of 1.54, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-5-cyclopropyltriazol-4-amine is sourced from PubChem (CID 79547670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).