N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine

C19H24N2 — CID 106902024

IUPACN-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
SMILESCc1ccccc1CN(C)CC1CNc2ccccc2C1
InChIInChI=1S/C19H24N2/c1-15-7-3-4-9-18(15)14-21(2)13-16-11-17-8-5-6-10-19(17)20-12-16/h3-10,16,20H,11-14H2,1-2H3
InChIKeyULEBYYMAECSQOC-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.71
Rot. Bonds4

About N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine

N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine (PubChem CID 106902024) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
PubChem CID106902024
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine
SMILESCc1ccccc1CN(C)CC1CNc2ccccc2C1
InChIInChI=1S/C19H24N2/c1-15-7-3-4-9-18(15)14-21(2)13-16-11-17-8-5-6-10-19(17)20-12-16/h3-10,16,20H,11-14H2,1-2H3
InChIKeyULEBYYMAECSQOC-UHFFFAOYSA-N
XLogP3.71
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
The IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine (CID 106902024) is N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine.
What is the SMILES notation for N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
The canonical SMILES for N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine is Cc1ccccc1CN(C)CC1CNc2ccccc2C1.
What is the InChIKey of N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
The InChIKey is ULEBYYMAECSQOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-15-7-3-4-9-18(15)14-21(2)13-16-11-17-8-5-6-10-19(17)20-12-16/h3-10,16,20H,11-14H2,1-2H3.
What are the key properties of N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine?
N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine has a molecular weight of 280.42 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylphenyl)methyl]-1-(1,2,3,4-tetrahydroquinolin-3-yl)methanamine is sourced from PubChem (CID 106902024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).