3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine

C19H20N2 — CID 105172695

IUPAC3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine
SMILESCc1ccc(CCC(N)c2ccc3cccnc3c2)cc1
InChIInChI=1S/C19H20N2/c1-14-4-6-15(7-5-14)8-11-18(20)17-10-9-16-3-2-12-21-19(16)13-17/h2-7,9-10,12-13,18H,8,11,20H2,1H3
InChIKeyYIXIOMDECFAOIJ-UHFFFAOYSA-N
MW276.38 g/mol
LogP4.18
Rot. Bonds4

About 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine

3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine (PubChem CID 105172695) has the molecular formula C19H20N2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine.

Molecular Properties

Compound Name3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine
PubChem CID105172695
Molecular FormulaC19H20N2
Molecular Weight276.38 g/mol
Exact Mass276.16
IUPAC Name3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine
SMILESCc1ccc(CCC(N)c2ccc3cccnc3c2)cc1
InChIInChI=1S/C19H20N2/c1-14-4-6-15(7-5-14)8-11-18(20)17-10-9-16-3-2-12-21-19(16)13-17/h2-7,9-10,12-13,18H,8,11,20H2,1H3
InChIKeyYIXIOMDECFAOIJ-UHFFFAOYSA-N
XLogP4.18
TPSA38.91 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 ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-ol
CID 105118985
4-phenyl-1-quinolin-7-ylbutan-1-amine
CID 105172595
2-(4-methylphenyl)-1-quinolin-6-ylethanamine
CID 63097383
(2,5-dimethylphenyl)-quinolin-7-ylmethanamine
CID 105021483
3-(2-methylphenyl)-1-quinolin-6-ylpropan-1-amine
CID 105172408
2-propan-2-ylsulfanyl-1-quinolin-7-ylethanamine
CID 81231763
2,2-dimethyl-1-quinolin-7-ylpropan-1-amine
CID 81220535
1-quinolin-6-ylbutan-1-amine
CID 63095616
pyrimidin-2-yl(quinolin-7-yl)methanamine
CID 81220998
(4-propan-2-ylphenyl)-quinolin-7-ylmethanamine
CID 81210653
5-methyl-1-quinolin-6-ylhexan-1-amine
CID 83161358
3-(3-methylphenyl)-1-naphthalen-2-ylpropan-1-amine
CID 105141723

Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine?
The IUPAC name of 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine (CID 105172695) is 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine.
What is the SMILES notation for 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine?
The canonical SMILES for 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine is Cc1ccc(CCC(N)c2ccc3cccnc3c2)cc1.
What is the InChIKey of 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine?
The InChIKey is YIXIOMDECFAOIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2/c1-14-4-6-15(7-5-14)8-11-18(20)17-10-9-16-3-2-12-21-19(16)13-17/h2-7,9-10,12-13,18H,8,11,20H2,1H3.
What are the key properties of 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine?
3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine has a molecular weight of 276.38 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-1-quinolin-7-ylpropan-1-amine is sourced from PubChem (CID 105172695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).