1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine

C14H16N2 — CID 81220023

IUPAC1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine
SMILESCNC(c1cccc2cccnc12)C1CC1
InChIInChI=1S/C14H16N2/c1-15-13(11-7-8-11)12-6-2-4-10-5-3-9-16-14(10)12/h2-6,9,11,13,15H,7-8H2,1H3
InChIKeyJBSFMRWOGUDZEG-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.91
Rot. Bonds3

About 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine

1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine (PubChem CID 81220023) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine
PubChem CID81220023
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine
SMILESCNC(c1cccc2cccnc12)C1CC1
InChIInChI=1S/C14H16N2/c1-15-13(11-7-8-11)12-6-2-4-10-5-3-9-16-14(10)12/h2-6,9,11,13,15H,7-8H2,1H3
InChIKeyJBSFMRWOGUDZEG-UHFFFAOYSA-N
XLogP2.91
TPSA24.92 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 ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine?
The IUPAC name of 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine (CID 81220023) is 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine.
What is the SMILES notation for 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine?
The canonical SMILES for 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine is CNC(c1cccc2cccnc12)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine?
The InChIKey is JBSFMRWOGUDZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-15-13(11-7-8-11)12-6-2-4-10-5-3-9-16-14(10)12/h2-6,9,11,13,15H,7-8H2,1H3.
What are the key properties of 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine?
1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine has a molecular weight of 212.30 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-1-quinolin-8-ylmethanamine is sourced from PubChem (CID 81220023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).