1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine

C10H18N4O — CID 107050311

IUPAC1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
SMILESCn1cc(CC(N)C2(C)CCCO2)nn1
InChIInChI=1S/C10H18N4O/c1-10(4-3-5-15-10)9(11)6-8-7-14(2)13-12-8/h7,9H,3-6,11H2,1-2H3
InChIKeyIPYVERVQCFSHTK-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.25
Rot. Bonds3

About 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine

1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine (PubChem CID 107050311) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine.

Molecular Properties

Compound Name1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
PubChem CID107050311
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
SMILESCn1cc(CC(N)C2(C)CCCO2)nn1
InChIInChI=1S/C10H18N4O/c1-10(4-3-5-15-10)9(11)6-8-7-14(2)13-12-8/h7,9H,3-6,11H2,1-2H3
InChIKeyIPYVERVQCFSHTK-UHFFFAOYSA-N
XLogP0.25
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107063793
N-methyl-1-(2-methyloxan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107050468
2-(1-methyltriazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
CID 107049977
1-(2-methyloxolan-2-yl)-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050310
1-[1-hydroxy-2-(1-methyltriazol-4-yl)ethyl]cycloheptan-1-ol
CID 107048234
4-methyl-N-[(1-methyltriazol-4-yl)methyl]oxan-4-amine
CID 115758120
1-(2-methyloxan-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103011693
2-amino-3-(1-methyltriazol-4-yl)propan-1-ol
CID 107055170
1-(1-methyltriazol-4-yl)-3-(oxan-2-yl)propan-2-amine
CID 107050849
2-(1-methyltriazol-4-yl)-1-(oxolan-3-yl)ethanamine
CID 107049452
1-(2-methyloxolan-3-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107064153
1-(1-ethoxycycloheptyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107048191

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine?
The IUPAC name of 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine (CID 107050311) is 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine.
What is the SMILES notation for 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine?
The canonical SMILES for 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine is Cn1cc(CC(N)C2(C)CCCO2)nn1.
What is the InChIKey of 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine?
The InChIKey is IPYVERVQCFSHTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-10(4-3-5-15-10)9(11)6-8-7-14(2)13-12-8/h7,9H,3-6,11H2,1-2H3.
What are the key properties of 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine?
1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine has a molecular weight of 210.28 g/mol, XLogP of 0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine is sourced from PubChem (CID 107050311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).