N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine

C18H19N3 — CID 62551242

IUPACN-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine
SMILESCCNC(Cc1ccncc1)c1cnc2ccccc2c1
InChIInChI=1S/C18H19N3/c1-2-20-18(11-14-7-9-19-10-8-14)16-12-15-5-3-4-6-17(15)21-13-16/h3-10,12-13,18,20H,2,11H2,1H3
InChIKeyPHAOUUBLOUJCSG-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.52
Rot. Bonds5

About N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine

N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine (PubChem CID 62551242) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine.

Molecular Properties

Compound NameN-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine
PubChem CID62551242
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC NameN-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine
SMILESCCNC(Cc1ccncc1)c1cnc2ccccc2c1
InChIInChI=1S/C18H19N3/c1-2-20-18(11-14-7-9-19-10-8-14)16-12-15-5-3-4-6-17(15)21-13-16/h3-10,12-13,18,20H,2,11H2,1H3
InChIKeyPHAOUUBLOUJCSG-UHFFFAOYSA-N
XLogP3.52
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-methyl-1-quinolin-3-ylpentan-1-amine
CID 115798075
N-ethyl-2-ethylsulfanyl-1-quinolin-3-ylethanamine
CID 65127903
3-ethoxy-N-ethyl-1-quinolin-3-ylpropan-1-amine
CID 105097975
N-ethyl-3,4,4-trimethyl-1-quinolin-3-ylpentan-1-amine
CID 115797681
N-ethyl-1-(5-fluoro-3-pyridinyl)-2-pyridin-4-ylethanamine
CID 62551241
N-[(4-methylphenyl)-quinolin-3-ylmethyl]ethanamine
CID 60923858
N-[(2-methylpyrimidin-4-yl)-quinolin-3-ylmethyl]ethanamine
CID 115530915
1-quinolin-3-ylbutylhydrazine
CID 105202157
[2-(3-methylphenyl)-1-quinolin-3-ylethyl]hydrazine
CID 105208945
N-ethyl-1-(5-methylthiophen-3-yl)-2-pyridin-4-ylethanamine
CID 65104859
N-ethyl-1-phenyl-2-quinoxalin-2-ylethanamine
CID 63200105
N-ethyl-1-(3-methoxypyrazin-2-yl)-2-pyridin-4-ylethanamine
CID 104515498

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine?
The IUPAC name of N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine (CID 62551242) is N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine.
What is the SMILES notation for N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine?
The canonical SMILES for N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine is CCNC(Cc1ccncc1)c1cnc2ccccc2c1.
What is the InChIKey of N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine?
The InChIKey is PHAOUUBLOUJCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-2-20-18(11-14-7-9-19-10-8-14)16-12-15-5-3-4-6-17(15)21-13-16/h3-10,12-13,18,20H,2,11H2,1H3.
What are the key properties of N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine?
N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine has a molecular weight of 277.37 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-pyridin-4-yl-1-quinolin-3-ylethanamine is sourced from PubChem (CID 62551242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).