1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine

C11H20N4O — CID 107051012

IUPAC1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine
SMILESCCOC(C(N)Cc1cn(C)nn1)C1CC1
InChIInChI=1S/C11H20N4O/c1-3-16-11(8-4-5-8)10(12)6-9-7-15(2)14-13-9/h7-8,10-11H,3-6,12H2,1-2H3
InChIKeyGELKTUHYWFTORX-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.50
Rot. Bonds6

About 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine

1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine (PubChem CID 107051012) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine
PubChem CID107051012
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine
SMILESCCOC(C(N)Cc1cn(C)nn1)C1CC1
InChIInChI=1S/C11H20N4O/c1-3-16-11(8-4-5-8)10(12)6-9-7-15(2)14-13-9/h7-8,10-11H,3-6,12H2,1-2H3
InChIKeyGELKTUHYWFTORX-UHFFFAOYSA-N
XLogP0.50
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

1-(4-ethylcyclohexyl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107049489
1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-one
CID 107047497
1-cyclohexyl-1-ethoxy-3-(1-propan-2-ylpyrazol-3-yl)propan-2-amine
CID 116772099
1-(4-methylcyclohexyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107046119
2-(1-methyltriazol-4-yl)-1-(oxolan-3-yl)ethanamine
CID 107049452
1-cyclobutyl-2-(1-methyltriazol-4-yl)ethanol
CID 107046208
1-cyclopropyl-3-(2,6-difluorophenyl)-1-ethoxypropan-2-amine
CID 114932668
1-(2-methyloxolan-3-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107064153
4-(1-methyltriazol-4-yl)butan-2-amine
CID 107044565
1-[(2-methylpropan-2-yl)oxy]-3-(1-methyltriazol-4-yl)propan-2-amine
CID 107063713
[1-(4-tert-butylcyclohexyl)-2-(1-methyltriazol-4-yl)ethyl]hydrazine
CID 107066160
2-amino-3-(1-methyltriazol-4-yl)propan-1-ol
CID 107055170

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine?
The IUPAC name of 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine (CID 107051012) is 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine.
What is the SMILES notation for 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine?
The canonical SMILES for 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine is CCOC(C(N)Cc1cn(C)nn1)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine?
The InChIKey is GELKTUHYWFTORX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-3-16-11(8-4-5-8)10(12)6-9-7-15(2)14-13-9/h7-8,10-11H,3-6,12H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine?
1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine has a molecular weight of 224.31 g/mol, XLogP of 0.50, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-ethoxy-3-(1-methyltriazol-4-yl)propan-2-amine is sourced from PubChem (CID 107051012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).