2-cyclopropyl-1-quinolin-5-ylethanamine

C14H16N2 — CID 79015948

IUPAC2-cyclopropyl-1-quinolin-5-ylethanamine
SMILESNC(CC1CC1)c1cccc2ncccc12
InChIInChI=1S/C14H16N2/c15-13(9-10-6-7-10)11-3-1-5-14-12(11)4-2-8-16-14/h1-5,8,10,13H,6-7,9,15H2
InChIKeyPWBHECHUNYLYHD-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.03
Rot. Bonds3

About 2-cyclopropyl-1-quinolin-5-ylethanamine

2-cyclopropyl-1-quinolin-5-ylethanamine (PubChem CID 79015948) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 2-cyclopropyl-1-quinolin-5-ylethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-quinolin-5-ylethanamine
PubChem CID79015948
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name2-cyclopropyl-1-quinolin-5-ylethanamine
SMILESNC(CC1CC1)c1cccc2ncccc12
InChIInChI=1S/C14H16N2/c15-13(9-10-6-7-10)11-3-1-5-14-12(11)4-2-8-16-14/h1-5,8,10,13H,6-7,9,15H2
InChIKeyPWBHECHUNYLYHD-UHFFFAOYSA-N
XLogP3.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-1-quinolin-5-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-quinolin-5-ylethanamine?
The IUPAC name of 2-cyclopropyl-1-quinolin-5-ylethanamine (CID 79015948) is 2-cyclopropyl-1-quinolin-5-ylethanamine.
What is the SMILES notation for 2-cyclopropyl-1-quinolin-5-ylethanamine?
The canonical SMILES for 2-cyclopropyl-1-quinolin-5-ylethanamine is NC(CC1CC1)c1cccc2ncccc12.
What is the InChIKey of 2-cyclopropyl-1-quinolin-5-ylethanamine?
The InChIKey is PWBHECHUNYLYHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c15-13(9-10-6-7-10)11-3-1-5-14-12(11)4-2-8-16-14/h1-5,8,10,13H,6-7,9,15H2.
What are the key properties of 2-cyclopropyl-1-quinolin-5-ylethanamine?
2-cyclopropyl-1-quinolin-5-ylethanamine has a molecular weight of 212.30 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-quinolin-5-ylethanamine is sourced from PubChem (CID 79015948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).