2-ethoxy-1-quinolin-3-ylbutan-1-amine

C15H20N2O — CID 116716202

IUPAC2-ethoxy-1-quinolin-3-ylbutan-1-amine
SMILESCCOC(CC)C(N)c1cnc2ccccc2c1
InChIInChI=1S/C15H20N2O/c1-3-14(18-4-2)15(16)12-9-11-7-5-6-8-13(11)17-10-12/h5-10,14-15H,3-4,16H2,1-2H3
InChIKeyBNZCOQYHUOFHMY-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.05
Rot. Bonds5

About 2-ethoxy-1-quinolin-3-ylbutan-1-amine

2-ethoxy-1-quinolin-3-ylbutan-1-amine (PubChem CID 116716202) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-ethoxy-1-quinolin-3-ylbutan-1-amine.

Molecular Properties

Compound Name2-ethoxy-1-quinolin-3-ylbutan-1-amine
PubChem CID116716202
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-ethoxy-1-quinolin-3-ylbutan-1-amine
SMILESCCOC(CC)C(N)c1cnc2ccccc2c1
InChIInChI=1S/C15H20N2O/c1-3-14(18-4-2)15(16)12-9-11-7-5-6-8-13(11)17-10-12/h5-10,14-15H,3-4,16H2,1-2H3
InChIKeyBNZCOQYHUOFHMY-UHFFFAOYSA-N
XLogP3.05
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-1-quinolin-3-ylpropan-1-amine
CID 64542181
2-phenyl-1-quinolin-3-ylbutan-1-amine
CID 115798275
ethyl (3S)-3-amino-3-quinolin-3-ylpropanoate
CID 34177500
2-methoxy-3-methyl-1-quinolin-3-ylbutan-1-amine
CID 116719597
2-ethoxy-3,3-dimethyl-1-quinolin-3-ylbutan-1-ol
CID 116713427
2-ethoxy-N,3-dimethyl-1-quinolin-3-ylbutan-1-amine
CID 116721032
2-quinolin-3-ylbutanamide
CID 154121490
(2-ethoxy-2-ethyl-1-quinolin-3-ylbutyl)hydrazine
CID 105275103
3-ethoxy-N-ethyl-1-quinolin-3-ylpropan-1-amine
CID 105097975
2-ethoxy-1-(3-methylphenyl)butan-1-amine
CID 116716374
(2-ethoxy-2-methyl-1-quinolin-3-ylpropyl)hydrazine
CID 105274101
(4-ethoxyphenyl)-quinolin-3-ylmethanol
CID 63893046

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-quinolin-3-ylbutan-1-amine?
The IUPAC name of 2-ethoxy-1-quinolin-3-ylbutan-1-amine (CID 116716202) is 2-ethoxy-1-quinolin-3-ylbutan-1-amine.
What is the SMILES notation for 2-ethoxy-1-quinolin-3-ylbutan-1-amine?
The canonical SMILES for 2-ethoxy-1-quinolin-3-ylbutan-1-amine is CCOC(CC)C(N)c1cnc2ccccc2c1.
What is the InChIKey of 2-ethoxy-1-quinolin-3-ylbutan-1-amine?
The InChIKey is BNZCOQYHUOFHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-3-14(18-4-2)15(16)12-9-11-7-5-6-8-13(11)17-10-12/h5-10,14-15H,3-4,16H2,1-2H3.
What are the key properties of 2-ethoxy-1-quinolin-3-ylbutan-1-amine?
2-ethoxy-1-quinolin-3-ylbutan-1-amine has a molecular weight of 244.34 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-quinolin-3-ylbutan-1-amine is sourced from PubChem (CID 116716202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).