1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine

C10H18N4 — CID 131031497

IUPAC1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine
SMILESCc1nc(NCC2(C)CCC2)nn1C
InChIInChI=1S/C10H18N4/c1-8-12-9(13-14(8)3)11-7-10(2)5-4-6-10/h4-7H2,1-3H3,(H,11,13)
InChIKeyUJUVKKOUJIYRRG-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.73
Rot. Bonds3

About 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine

1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine (PubChem CID 131031497) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine
PubChem CID131031497
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine
SMILESCc1nc(NCC2(C)CCC2)nn1C
InChIInChI=1S/C10H18N4/c1-8-12-9(13-14(8)3)11-7-10(2)5-4-6-10/h4-7H2,1-3H3,(H,11,13)
InChIKeyUJUVKKOUJIYRRG-UHFFFAOYSA-N
XLogP1.73
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine?
The IUPAC name of 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine (CID 131031497) is 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine.
What is the SMILES notation for 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine?
The canonical SMILES for 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine is Cc1nc(NCC2(C)CCC2)nn1C.
What is the InChIKey of 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine?
The InChIKey is UJUVKKOUJIYRRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-8-12-9(13-14(8)3)11-7-10(2)5-4-6-10/h4-7H2,1-3H3,(H,11,13).
What are the key properties of 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine?
1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine has a molecular weight of 194.28 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine is sourced from PubChem (CID 131031497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).