N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine

C18H19N3 — CID 105146311

IUPACN-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine
SMILESCCNC(c1ccc(C)nc1)c1ccnc2ccccc12
InChIInChI=1S/C18H19N3/c1-3-19-18(14-9-8-13(2)21-12-14)16-10-11-20-17-7-5-4-6-15(16)17/h4-12,18-19H,3H2,1-2H3
InChIKeyJIVVQQDQDXDBBW-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.64
Rot. Bonds4

About N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine

N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine (PubChem CID 105146311) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine.

Molecular Properties

Compound NameN-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine
PubChem CID105146311
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC NameN-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine
SMILESCCNC(c1ccc(C)nc1)c1ccnc2ccccc12
InChIInChI=1S/C18H19N3/c1-3-19-18(14-9-8-13(2)21-12-14)16-10-11-20-17-7-5-4-6-15(16)17/h4-12,18-19H,3H2,1-2H3
InChIKeyJIVVQQDQDXDBBW-UHFFFAOYSA-N
XLogP3.64
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[pyrimidin-5-yl(quinolin-4-yl)methyl]ethanamine
CID 105119009
N-[(1-methylpyrazol-4-yl)-quinolin-4-ylmethyl]ethanamine
CID 105104643
N-[(5-methylpyrazin-2-yl)-quinolin-5-ylmethyl]ethanamine
CID 105172000
N-[(6-methyl-3-pyridinyl)-[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 115854580
N-[(2-methylquinolin-4-yl)-pyridin-3-ylmethyl]ethanamine
CID 105098479
N-[(2,3-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854598
N-[furan-3-yl(quinolin-5-yl)methyl]ethanamine
CID 81232108
N-[(2,3-dichlorophenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854889
N-[(2,4-dimethylphenyl)-(6-methyl-3-pyridinyl)methyl]ethanamine
CID 115854963
N-[(6-methyl-3-pyridinyl)-naphthalen-2-ylmethyl]ethanamine
CID 63155569
N-[pyridin-2-yl(quinolin-5-yl)methyl]ethanamine
CID 81220016
N-[(1-ethylpyrazol-4-yl)-quinolin-5-ylmethyl]ethanamine
CID 105108998

Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine?
The IUPAC name of N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine (CID 105146311) is N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine.
What is the SMILES notation for N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine?
The canonical SMILES for N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine is CCNC(c1ccc(C)nc1)c1ccnc2ccccc12.
What is the InChIKey of N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine?
The InChIKey is JIVVQQDQDXDBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-3-19-18(14-9-8-13(2)21-12-14)16-10-11-20-17-7-5-4-6-15(16)17/h4-12,18-19H,3H2,1-2H3.
What are the key properties of N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine?
N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine has a molecular weight of 277.37 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-3-pyridinyl)-quinolin-4-ylmethyl]ethanamine is sourced from PubChem (CID 105146311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).