N-(triazol-1-ylmethyl)cyclopentanamine

C8H14N4 — CID 141214899

IUPACN-(triazol-1-ylmethyl)cyclopentanamine
SMILESc1cn(CNC2CCCC2)nn1
InChIInChI=1S/C8H14N4/c1-2-4-8(3-1)9-7-12-6-5-10-11-12/h5-6,8-9H,1-4,7H2
InChIKeyUWLQTNHUHMVOGE-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.77
Rot. Bonds3

About N-(triazol-1-ylmethyl)cyclopentanamine

N-(triazol-1-ylmethyl)cyclopentanamine (PubChem CID 141214899) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is N-(triazol-1-ylmethyl)cyclopentanamine.

Molecular Properties

Compound NameN-(triazol-1-ylmethyl)cyclopentanamine
PubChem CID141214899
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC NameN-(triazol-1-ylmethyl)cyclopentanamine
SMILESc1cn(CNC2CCCC2)nn1
InChIInChI=1S/C8H14N4/c1-2-4-8(3-1)9-7-12-6-5-10-11-12/h5-6,8-9H,1-4,7H2
InChIKeyUWLQTNHUHMVOGE-UHFFFAOYSA-N
XLogP0.77
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(triazol-1-ylmethyl)cyclopentanamine?
The IUPAC name of N-(triazol-1-ylmethyl)cyclopentanamine (CID 141214899) is N-(triazol-1-ylmethyl)cyclopentanamine.
What is the SMILES notation for N-(triazol-1-ylmethyl)cyclopentanamine?
The canonical SMILES for N-(triazol-1-ylmethyl)cyclopentanamine is c1cn(CNC2CCCC2)nn1.
What is the InChIKey of N-(triazol-1-ylmethyl)cyclopentanamine?
The InChIKey is UWLQTNHUHMVOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-2-4-8(3-1)9-7-12-6-5-10-11-12/h5-6,8-9H,1-4,7H2.
What are the key properties of N-(triazol-1-ylmethyl)cyclopentanamine?
N-(triazol-1-ylmethyl)cyclopentanamine has a molecular weight of 166.23 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(triazol-1-ylmethyl)cyclopentanamine is sourced from PubChem (CID 141214899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).