1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine

C19H28N2 — CID 81230551

IUPAC1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCc1ccc2nc(C)ccc2c1
InChIInChI=1S/C19H28N2/c1-4-6-18(20-13-5-2)11-8-16-9-12-19-17(14-16)10-7-15(3)21-19/h7,9-10,12,14,18,20H,4-6,8,11,13H2,1-3H3
InChIKeyKAMZZSXQCJMFIX-UHFFFAOYSA-N
MW284.45 g/mol
LogP4.64
Rot. Bonds8

About 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine

1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine (PubChem CID 81230551) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine.

Molecular Properties

Compound Name1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine
PubChem CID81230551
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC Name1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine
SMILESCCCNC(CCC)CCc1ccc2nc(C)ccc2c1
InChIInChI=1S/C19H28N2/c1-4-6-18(20-13-5-2)11-8-16-9-12-19-17(14-16)10-7-15(3)21-19/h7,9-10,12,14,18,20H,4-6,8,11,13H2,1-3H3
InChIKeyKAMZZSXQCJMFIX-UHFFFAOYSA-N
XLogP4.64
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-methylquinolin-6-yl)-N-propylpropan-1-amine
CID 81221614
6-(3-bromopentyl)-2-methylquinoline
CID 81221482
2-methyl-N-[2-(2-methylquinolin-6-yl)ethyl]propan-2-amine
CID 81224077
1-(2-methylquinolin-6-yl)-3-methylsulfanyl-N-propylpropan-1-amine
CID 105172233
1-(2-methylquinolin-6-yl)-N-propylpropan-1-amine
CID 81220852
1-(4-iodophenyl)-N-propylhexan-3-amine
CID 65479065
3-(2-methylquinolin-6-yl)-3-(propylamino)propan-1-ol
CID 105379697
2-(2-methylquinolin-6-yl)-2-(propylamino)ethanol
CID 105379248
3-methyl-1-(2-methylquinolin-6-yl)-N-propylbutan-1-amine
CID 81220093
6-(3-bromopropyl)-2-methylquinoline
CID 81221400
3-methyl-N-[(2-methylquinolin-6-yl)methyl]pentan-2-amine
CID 105378393
N-ethyl-1-quinolin-7-ylhexan-3-amine
CID 81221619

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine?
The IUPAC name of 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine (CID 81230551) is 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine.
What is the SMILES notation for 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine?
The canonical SMILES for 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine is CCCNC(CCC)CCc1ccc2nc(C)ccc2c1.
What is the InChIKey of 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine?
The InChIKey is KAMZZSXQCJMFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-4-6-18(20-13-5-2)11-8-16-9-12-19-17(14-16)10-7-15(3)21-19/h7,9-10,12,14,18,20H,4-6,8,11,13H2,1-3H3.
What are the key properties of 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine?
1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine has a molecular weight of 284.45 g/mol, XLogP of 4.64, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylquinolin-6-yl)-N-propylhexan-3-amine is sourced from PubChem (CID 81230551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).