2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine

C15H20N2 — CID 62603664

IUPAC2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine
SMILESCC(C)CNCCc1cnc2ccccc2c1
InChIInChI=1S/C15H20N2/c1-12(2)10-16-8-7-13-9-14-5-3-4-6-15(14)17-11-13/h3-6,9,11-12,16H,7-8,10H2,1-2H3
InChIKeyRAHKAQZYBQJETF-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.02
Rot. Bonds5

About 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine

2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine (PubChem CID 62603664) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine
PubChem CID62603664
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine
SMILESCC(C)CNCCc1cnc2ccccc2c1
InChIInChI=1S/C15H20N2/c1-12(2)10-16-8-7-13-9-14-5-3-4-6-15(14)17-11-13/h3-6,9,11-12,16H,7-8,10H2,1-2H3
InChIKeyRAHKAQZYBQJETF-UHFFFAOYSA-N
XLogP3.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.02
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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Related Compounds

3-(2-methylpropyl)quinoline
CID 12072851
3-(3-chloro-4-methylpentyl)quinoline
CID 64508881
N-(2-methylpropyl)-2-quinolin-3-yloxybutan-1-amine
CID 107387767
2-quinolin-3-ylethanol
CID 53403774
2-methyl-N-(3-quinolin-3-ylpropyl)propan-2-amine
CID 64506111
N-(quinolin-3-ylmethyl)ethanamine
CID 16640553
3-(3,3-dimethylbutyl)quinoline
CID 58808300
1-(quinolin-3-ylmethylamino)ethanol
CID 143559456
3-(4-phenylpentyl)quinoline
CID 158257527
2-quinolin-3-ylethanamine;hydrochloride
CID 68724239
2-methyl-3-quinolin-3-ylpropan-1-amine
CID 64664749
3-(3-bromo-4,4-dimethylpentyl)quinoline
CID 64506762

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine?
The IUPAC name of 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine (CID 62603664) is 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine?
The canonical SMILES for 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine is CC(C)CNCCc1cnc2ccccc2c1.
What is the InChIKey of 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine?
The InChIKey is RAHKAQZYBQJETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-12(2)10-16-8-7-13-9-14-5-3-4-6-15(14)17-11-13/h3-6,9,11-12,16H,7-8,10H2,1-2H3.
What are the key properties of 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine?
2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine has a molecular weight of 228.34 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-quinolin-3-ylethyl)propan-1-amine is sourced from PubChem (CID 62603664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).