N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine

C11H21N5 — CID 62419091

IUPACN-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine
SMILESCN(CCn1cc(CN)nn1)C1CCCC1
InChIInChI=1S/C11H21N5/c1-15(11-4-2-3-5-11)6-7-16-9-10(8-12)13-14-16/h9,11H,2-8,12H2,1H3
InChIKeyOLSHXBIOZGZGQU-UHFFFAOYSA-N
MW223.32 g/mol
LogP0.61
Rot. Bonds5

About N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine

N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine (PubChem CID 62419091) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine.

Molecular Properties

Compound NameN-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine
PubChem CID62419091
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC NameN-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine
SMILESCN(CCn1cc(CN)nn1)C1CCCC1
InChIInChI=1S/C11H21N5/c1-15(11-4-2-3-5-11)6-7-16-9-10(8-12)13-14-16/h9,11H,2-8,12H2,1H3
InChIKeyOLSHXBIOZGZGQU-UHFFFAOYSA-N
XLogP0.61
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[4-[(cyclopropylamino)methyl]triazol-1-yl]ethyl]-N-methylcyclopentanamine
CID 62418703
N-[2-[4-[(tert-butylamino)methyl]triazol-1-yl]ethyl]-N-methylcyclohexanamine
CID 62425720
2-[4-(aminomethyl)triazol-1-yl]-N-[2-[cyclopentyl(methyl)amino]ethyl]acetamide
CID 115459869
1-[2-[cyclopentyl(methyl)amino]ethyl]triazole-4-carboxylic acid
CID 43267317
N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylaniline
CID 55069972
N,2-dimethyl-N-[2-[4-(methylaminomethyl)triazol-1-yl]ethyl]cyclohexan-1-amine
CID 62462234
N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylpentan-3-amine
CID 62433554
2-[4-(aminomethyl)triazol-1-yl]-N-cyclopentyl-N-ethylacetamide
CID 113314068
[1-[[(2R)-1-methylpiperidin-2-yl]methyl]triazol-4-yl]methanamine
CID 129496715
1-[1-[2-[4-(aminomethyl)triazol-1-yl]ethyl]piperidin-4-yl]-N,N-dimethylmethanamine
CID 55073697
[1-[2-(4-methylpiperidin-1-yl)ethyl]triazol-4-yl]methanamine
CID 62437886
[1-[2-(2-ethylazepan-1-yl)ethyl]triazol-4-yl]methanamine
CID 104690284

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine?
The IUPAC name of N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine (CID 62419091) is N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine.
What is the SMILES notation for N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine?
The canonical SMILES for N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine is CN(CCn1cc(CN)nn1)C1CCCC1.
What is the InChIKey of N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine?
The InChIKey is OLSHXBIOZGZGQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-15(11-4-2-3-5-11)6-7-16-9-10(8-12)13-14-16/h9,11H,2-8,12H2,1H3.
What are the key properties of N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine?
N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine has a molecular weight of 223.32 g/mol, XLogP of 0.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(aminomethyl)triazol-1-yl]ethyl]-N-methylcyclopentanamine is sourced from PubChem (CID 62419091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).