[2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine

C15H18N2O — CID 106199465

IUPAC[2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine
SMILESNCc1cc2ccccc2nc1OCCC1CC1
InChIInChI=1S/C15H18N2O/c16-10-13-9-12-3-1-2-4-14(12)17-15(13)18-8-7-11-5-6-11/h1-4,9,11H,5-8,10,16H2
InChIKeyQPXVTTXVUCFWQO-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.87
Rot. Bonds5

About [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine

[2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine (PubChem CID 106199465) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine
PubChem CID106199465
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine
SMILESNCc1cc2ccccc2nc1OCCC1CC1
InChIInChI=1S/C15H18N2O/c16-10-13-9-12-3-1-2-4-14(12)17-15(13)18-8-7-11-5-6-11/h1-4,9,11H,5-8,10,16H2
InChIKeyQPXVTTXVUCFWQO-UHFFFAOYSA-N
XLogP2.87
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine?
The IUPAC name of [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine (CID 106199465) is [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine.
What is the SMILES notation for [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine?
The canonical SMILES for [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine is NCc1cc2ccccc2nc1OCCC1CC1.
What is the InChIKey of [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine?
The InChIKey is QPXVTTXVUCFWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c16-10-13-9-12-3-1-2-4-14(12)17-15(13)18-8-7-11-5-6-11/h1-4,9,11H,5-8,10,16H2.
What are the key properties of [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine?
[2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine has a molecular weight of 242.32 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-cyclopropylethoxy)quinolin-3-yl]methanamine is sourced from PubChem (CID 106199465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).