2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine

C11H20N4 — CID 105043854

IUPAC2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine
SMILESCNC(CC1CCCC1)c1cnnn1C
InChIInChI=1S/C11H20N4/c1-12-10(7-9-5-3-4-6-9)11-8-13-14-15(11)2/h8-10,12H,3-7H2,1-2H3
InChIKeyGRYYNQPKSXMAQE-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.66
Rot. Bonds4

About 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine

2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine (PubChem CID 105043854) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine
PubChem CID105043854
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine
SMILESCNC(CC1CCCC1)c1cnnn1C
InChIInChI=1S/C11H20N4/c1-12-10(7-9-5-3-4-6-9)11-8-13-14-15(11)2/h8-10,12H,3-7H2,1-2H3
InChIKeyGRYYNQPKSXMAQE-UHFFFAOYSA-N
XLogP1.66
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclohexyl-1-(3-ethyltriazol-4-yl)-N-methylethanamine
CID 114213525
2-cyclopentyl-N-methyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 115858828
1-cyclooctyl-N-methyl-1-(3-methyltriazol-4-yl)methanamine
CID 114688757
N,3,3-trimethyl-1-(3-methyltriazol-4-yl)butan-1-amine
CID 114687748
[cyclooctyl-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105255052
2-cyclohexyl-N-methyl-1-(1-methylpyrazol-4-yl)ethanamine
CID 43485883
2-cyclopentyl-N-methyl-1-(2-propan-2-ylpyrazol-3-yl)ethanamine
CID 114198031
N-[cyclohexyl-(3-methyltriazol-4-yl)methyl]propan-1-amine
CID 114687199
2-(3,5-dimethylphenyl)-N-methyl-1-(3-methyltriazol-4-yl)ethanamine
CID 114687515
1-(3-methyltriazol-4-yl)-2-(thian-4-yl)ethanol
CID 105128683
N-methyl-1-(3-methyltriazol-4-yl)ethanamine
CID 114687181
2-cyclopentyl-1-(3-propyltriazol-4-yl)ethanol
CID 115834151

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine (CID 105043854) is 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine is CNC(CC1CCCC1)c1cnnn1C.
What is the InChIKey of 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine?
The InChIKey is GRYYNQPKSXMAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-12-10(7-9-5-3-4-6-9)11-8-13-14-15(11)2/h8-10,12H,3-7H2,1-2H3.
What are the key properties of 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine?
2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine has a molecular weight of 208.31 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-methyl-1-(3-methyltriazol-4-yl)ethanamine is sourced from PubChem (CID 105043854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).