N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine

C19H20N2 — CID 63095453

IUPACN-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine
SMILESCCNC(c1cccc(C)c1)c1ccc2ncccc2c1
InChIInChI=1S/C19H20N2/c1-3-20-19(16-7-4-6-14(2)12-16)17-9-10-18-15(13-17)8-5-11-21-18/h4-13,19-20H,3H2,1-2H3
InChIKeyUGCSVXMBFPIZTR-UHFFFAOYSA-N
MW276.38 g/mol
LogP4.24
Rot. Bonds4

About N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine

N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine (PubChem CID 63095453) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine.

Molecular Properties

Compound NameN-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine
PubChem CID63095453
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC NameN-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine
SMILESCCNC(c1cccc(C)c1)c1ccc2ncccc2c1
InChIInChI=1S/C19H20N2/c1-3-20-19(16-7-4-6-14(2)12-16)17-9-10-18-15(13-17)8-5-11-21-18/h4-13,19-20H,3H2,1-2H3
InChIKeyUGCSVXMBFPIZTR-UHFFFAOYSA-N
XLogP4.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-methylpyrazol-3-yl)-quinolin-6-ylmethyl]ethanamine
CID 63963933
N-[(3-fluorophenyl)-quinolin-7-ylmethyl]ethanamine
CID 81210647
N-[(3-chlorophenyl)-quinolin-7-ylmethyl]ethanamine
CID 81210398
N-[2,3-dihydrofuran-5-yl(quinolin-6-yl)methyl]ethanamine
CID 102651527
N-[(5-chlorothiophen-2-yl)-quinolin-6-ylmethyl]ethanamine
CID 78917810
N-[(4-methyl-2-pyridinyl)-quinolin-7-ylmethyl]ethanamine
CID 81228376
N-[(2-bromofuran-3-yl)-quinolin-6-ylmethyl]ethanamine
CID 106858324
N-[(4-methylphenyl)-quinolin-3-ylmethyl]ethanamine
CID 60923858
N-[isoquinolin-1-yl-(3-methylphenyl)methyl]ethanamine
CID 63948857
N-[(4-ethylphenyl)-(3-methylphenyl)methyl]ethanamine
CID 43491470
N-[(3-methylphenyl)-quinoxalin-2-ylmethyl]ethanamine
CID 107356920
N-ethyl-2,2-dimethoxy-1-quinolin-6-ylethanamine
CID 81232075

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine?
The IUPAC name of N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine (CID 63095453) is N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine.
What is the SMILES notation for N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine?
The canonical SMILES for N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine is CCNC(c1cccc(C)c1)c1ccc2ncccc2c1.
What is the InChIKey of N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine?
The InChIKey is UGCSVXMBFPIZTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-3-20-19(16-7-4-6-14(2)12-16)17-9-10-18-15(13-17)8-5-11-21-18/h4-13,19-20H,3H2,1-2H3.
What are the key properties of N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine?
N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine has a molecular weight of 276.38 g/mol, XLogP of 4.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylphenyl)-quinolin-6-ylmethyl]ethanamine is sourced from PubChem (CID 63095453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).