N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine

C15H20N2 — CID 82448157

IUPACN-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine
SMILESCNCc1cc(C(C)C)nc2ccc(C)cc12
InChIInChI=1S/C15H20N2/c1-10(2)15-8-12(9-16-4)13-7-11(3)5-6-14(13)17-15/h5-8,10,16H,9H2,1-4H3
InChIKeyPVZWIIAHGZCPQS-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.39
Rot. Bonds3

About N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine

N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine (PubChem CID 82448157) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine
PubChem CID82448157
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC NameN-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine
SMILESCNCc1cc(C(C)C)nc2ccc(C)cc12
InChIInChI=1S/C15H20N2/c1-10(2)15-8-12(9-16-4)13-7-11(3)5-6-14(13)17-15/h5-8,10,16H,9H2,1-4H3
InChIKeyPVZWIIAHGZCPQS-UHFFFAOYSA-N
XLogP3.39
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine?
The IUPAC name of N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine (CID 82448157) is N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine is CNCc1cc(C(C)C)nc2ccc(C)cc12.
What is the InChIKey of N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine?
The InChIKey is PVZWIIAHGZCPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-10(2)15-8-12(9-16-4)13-7-11(3)5-6-14(13)17-15/h5-8,10,16H,9H2,1-4H3.
What are the key properties of N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine?
N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine has a molecular weight of 228.34 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(6-methyl-2-propan-2-ylquinolin-4-yl)methanamine is sourced from PubChem (CID 82448157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).