N-(3-ethoxycyclobutyl)quinolin-6-amine

C15H18N2O — CID 112573906

IUPACN-(3-ethoxycyclobutyl)quinolin-6-amine
SMILESCCOC1CC(Nc2ccc3ncccc3c2)C1
InChIInChI=1S/C15H18N2O/c1-2-18-14-9-13(10-14)17-12-5-6-15-11(8-12)4-3-7-16-15/h3-8,13-14,17H,2,9-10H2,1H3
InChIKeyWVWJOWHDSQCRST-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.21
Rot. Bonds4

About N-(3-ethoxycyclobutyl)quinolin-6-amine

N-(3-ethoxycyclobutyl)quinolin-6-amine (PubChem CID 112573906) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(3-ethoxycyclobutyl)quinolin-6-amine.

Molecular Properties

Compound NameN-(3-ethoxycyclobutyl)quinolin-6-amine
PubChem CID112573906
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-(3-ethoxycyclobutyl)quinolin-6-amine
SMILESCCOC1CC(Nc2ccc3ncccc3c2)C1
InChIInChI=1S/C15H18N2O/c1-2-18-14-9-13(10-14)17-12-5-6-15-11(8-12)4-3-7-16-15/h3-8,13-14,17H,2,9-10H2,1H3
InChIKeyWVWJOWHDSQCRST-UHFFFAOYSA-N
XLogP3.21
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxycyclobutyl)quinolin-6-amine?
The IUPAC name of N-(3-ethoxycyclobutyl)quinolin-6-amine (CID 112573906) is N-(3-ethoxycyclobutyl)quinolin-6-amine.
What is the SMILES notation for N-(3-ethoxycyclobutyl)quinolin-6-amine?
The canonical SMILES for N-(3-ethoxycyclobutyl)quinolin-6-amine is CCOC1CC(Nc2ccc3ncccc3c2)C1.
What is the InChIKey of N-(3-ethoxycyclobutyl)quinolin-6-amine?
The InChIKey is WVWJOWHDSQCRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-2-18-14-9-13(10-14)17-12-5-6-15-11(8-12)4-3-7-16-15/h3-8,13-14,17H,2,9-10H2,1H3.
What are the key properties of N-(3-ethoxycyclobutyl)quinolin-6-amine?
N-(3-ethoxycyclobutyl)quinolin-6-amine has a molecular weight of 242.32 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxycyclobutyl)quinolin-6-amine is sourced from PubChem (CID 112573906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).