(2,4-dimethylphenyl)-quinolin-2-ylmethanamine

C18H18N2 — CID 63222466

IUPAC(2,4-dimethylphenyl)-quinolin-2-ylmethanamine
SMILESCc1ccc(C(N)c2ccc3ccccc3n2)c(C)c1
InChIInChI=1S/C18H18N2/c1-12-7-9-15(13(2)11-12)18(19)17-10-8-14-5-3-4-6-16(14)20-17/h3-11,18H,19H2,1-2H3
InChIKeyWBKANCRSRPRBIZ-UHFFFAOYSA-N
MW262.36 g/mol
LogP3.90
Rot. Bonds2

About (2,4-dimethylphenyl)-quinolin-2-ylmethanamine

(2,4-dimethylphenyl)-quinolin-2-ylmethanamine (PubChem CID 63222466) has the molecular formula C18H18N2 and a molecular weight of 262.36 g/mol. Its IUPAC name is (2,4-dimethylphenyl)-quinolin-2-ylmethanamine.

Molecular Properties

Compound Name(2,4-dimethylphenyl)-quinolin-2-ylmethanamine
PubChem CID63222466
Molecular FormulaC18H18N2
Molecular Weight262.36 g/mol
Exact Mass262.15
IUPAC Name(2,4-dimethylphenyl)-quinolin-2-ylmethanamine
SMILESCc1ccc(C(N)c2ccc3ccccc3n2)c(C)c1
InChIInChI=1S/C18H18N2/c1-12-7-9-15(13(2)11-12)18(19)17-10-8-14-5-3-4-6-16(14)20-17/h3-11,18H,19H2,1-2H3
InChIKeyWBKANCRSRPRBIZ-UHFFFAOYSA-N
XLogP3.90
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,4-dimethylphenyl)-quinolin-2-ylmethanol
CID 63222882
(2,5-dimethylphenyl)-quinolin-2-ylmethanol
CID 63222339
(2,4-dimethylphenyl)-(2-methylphenyl)methanamine
CID 43198494
(2,6-difluoro-3-methylphenyl)-quinolin-2-ylmethanamine
CID 82802155
(1S)-1-quinolin-2-ylethanamine;hydrochloride
CID 171236571
(1R)-1-quinolin-2-ylethanamine;hydrochloride
CID 171216934
[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine
CID 107357864
(4-fluoro-2-methylphenyl)-quinoxalin-2-ylmethanamine
CID 107357093
(4-fluoro-2-methylphenyl)-(4-methylquinolin-2-yl)methanamine
CID 114754987
2-(2,5-dimethylphenyl)quinoline
CID 1202732
(3-bromo-2-fluorophenyl)-quinolin-2-ylmethanamine
CID 106645567
amino(quinolin-2-yl)methanol
CID 154237779

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylphenyl)-quinolin-2-ylmethanamine?
The IUPAC name of (2,4-dimethylphenyl)-quinolin-2-ylmethanamine (CID 63222466) is (2,4-dimethylphenyl)-quinolin-2-ylmethanamine.
What is the SMILES notation for (2,4-dimethylphenyl)-quinolin-2-ylmethanamine?
The canonical SMILES for (2,4-dimethylphenyl)-quinolin-2-ylmethanamine is Cc1ccc(C(N)c2ccc3ccccc3n2)c(C)c1.
What is the InChIKey of (2,4-dimethylphenyl)-quinolin-2-ylmethanamine?
The InChIKey is WBKANCRSRPRBIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2/c1-12-7-9-15(13(2)11-12)18(19)17-10-8-14-5-3-4-6-16(14)20-17/h3-11,18H,19H2,1-2H3.
What are the key properties of (2,4-dimethylphenyl)-quinolin-2-ylmethanamine?
(2,4-dimethylphenyl)-quinolin-2-ylmethanamine has a molecular weight of 262.36 g/mol, XLogP of 3.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylphenyl)-quinolin-2-ylmethanamine is sourced from PubChem (CID 63222466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).