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

C11H20N4 — CID 107063793

IUPAC1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine
SMILESCn1cc(CC(N)C2(C)CCCC2)nn1
InChIInChI=1S/C11H20N4/c1-11(5-3-4-6-11)10(12)7-9-8-15(2)14-13-9/h8,10H,3-7,12H2,1-2H3
InChIKeyQVERVSHDWPRRFB-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.27
Rot. Bonds3

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

1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine (PubChem CID 107063793) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine.

Molecular Properties

Compound Name1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine
PubChem CID107063793
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine
SMILESCn1cc(CC(N)C2(C)CCCC2)nn1
InChIInChI=1S/C11H20N4/c1-11(5-3-4-6-11)10(12)7-9-8-15(2)14-13-9/h8,10H,3-7,12H2,1-2H3
InChIKeyQVERVSHDWPRRFB-UHFFFAOYSA-N
XLogP1.27
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methyloxolan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107050311
2-(1-methyltriazol-4-yl)-1-(1-morpholin-4-ylcyclopentyl)ethanamine
CID 107049977
1-[1-hydroxy-2-(1-methyltriazol-4-yl)ethyl]cycloheptan-1-ol
CID 107048234
2-amino-3-(1-methyltriazol-4-yl)propan-1-ol
CID 107055170
N-methyl-1-(2-methyloxan-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107050468
1-(1-ethoxycycloheptyl)-2-(1-methyltriazol-4-yl)ethanol
CID 107048191
[1-[(1-methyltriazol-4-yl)methyl]cyclooctyl]methanamine
CID 107057461
1-[(1-methyltriazol-4-yl)methyl]cycloheptan-1-ol
CID 107045687
1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-ol
CID 107045659
N-methyl-2-(1-methyltriazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine
CID 107049969
1-(1-methylimidazol-2-yl)-2-(1-methyltriazol-4-yl)ethanamine
CID 107050560
1-(1-methylcyclopentyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103029892

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine?
The IUPAC name of 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine (CID 107063793) is 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine.
What is the SMILES notation for 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine?
The canonical SMILES for 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine is Cn1cc(CC(N)C2(C)CCCC2)nn1.
What is the InChIKey of 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine?
The InChIKey is QVERVSHDWPRRFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-11(5-3-4-6-11)10(12)7-9-8-15(2)14-13-9/h8,10H,3-7,12H2,1-2H3.
What are the key properties of 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine?
1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine has a molecular weight of 208.31 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclopentyl)-2-(1-methyltriazol-4-yl)ethanamine is sourced from PubChem (CID 107063793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).