2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine

C19H32N2 — CID 63466877

IUPAC2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine
SMILESCCCCCCCC(CN)N1CC(C)Cc2ccccc21
InChIInChI=1S/C19H32N2/c1-3-4-5-6-7-11-18(14-20)21-15-16(2)13-17-10-8-9-12-19(17)21/h8-10,12,16,18H,3-7,11,13-15,20H2,1-2H3
InChIKeyZMUIYISRNAAQCI-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.37
Rot. Bonds8

About 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine

2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine (PubChem CID 63466877) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine.

Molecular Properties

Compound Name2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine
PubChem CID63466877
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine
SMILESCCCCCCCC(CN)N1CC(C)Cc2ccccc21
InChIInChI=1S/C19H32N2/c1-3-4-5-6-7-11-18(14-20)21-15-16(2)13-17-10-8-9-12-19(17)21/h8-10,12,16,18H,3-7,11,13-15,20H2,1-2H3
InChIKeyZMUIYISRNAAQCI-UHFFFAOYSA-N
XLogP4.37
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine?
The IUPAC name of 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine (CID 63466877) is 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine.
What is the SMILES notation for 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine?
The canonical SMILES for 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine is CCCCCCCC(CN)N1CC(C)Cc2ccccc21.
What is the InChIKey of 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine?
The InChIKey is ZMUIYISRNAAQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-3-4-5-6-7-11-18(14-20)21-15-16(2)13-17-10-8-9-12-19(17)21/h8-10,12,16,18H,3-7,11,13-15,20H2,1-2H3.
What are the key properties of 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine?
2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine has a molecular weight of 288.48 g/mol, XLogP of 4.37, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)nonan-1-amine is sourced from PubChem (CID 63466877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).