2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine

C18H26N2 — CID 63562253

IUPAC2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine
SMILESCCCNC(CC)C(C)c1cc(C)nc2ccccc12
InChIInChI=1S/C18H26N2/c1-5-11-19-17(6-2)14(4)16-12-13(3)20-18-10-8-7-9-15(16)18/h7-10,12,14,17,19H,5-6,11H2,1-4H3
InChIKeyWZFMHGGJKKGLND-UHFFFAOYSA-N
MW270.42 g/mol
LogP4.42
Rot. Bonds6

About 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine

2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine (PubChem CID 63562253) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine.

Molecular Properties

Compound Name2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine
PubChem CID63562253
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine
SMILESCCCNC(CC)C(C)c1cc(C)nc2ccccc12
InChIInChI=1S/C18H26N2/c1-5-11-19-17(6-2)14(4)16-12-13(3)20-18-10-8-7-9-15(16)18/h7-10,12,14,17,19H,5-6,11H2,1-4H3
InChIKeyWZFMHGGJKKGLND-UHFFFAOYSA-N
XLogP4.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propyl-2-quinolin-4-ylpentan-3-amine
CID 63560165
1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine
CID 55162398
N-methyl-3-(2-methylquinolin-4-yl)butan-2-amine
CID 63199652
2-methyl-N-[(2-methylquinolin-4-yl)methyl]pentan-3-amine
CID 78942769
N-methyl-1-(2-methylquinolin-4-yl)butan-1-amine
CID 105080240
3-methyl-1-(2-methylquinolin-4-yl)pentan-1-ol
CID 79235619
(E)-3-methyl-4-(2-methylquinolin-4-yl)-N-propylbut-3-en-2-amine
CID 103093547
2-(2-fluorophenyl)-N-propylpentan-3-amine
CID 79308291
1-(2-methylquinolin-4-yl)pentan-1-ol
CID 79235698
ethyl 3-amino-3-(2-methylquinolin-4-yl)propanoate
CID 79237557
1-(2-methylquinolin-4-yl)octan-1-amine
CID 105124901
1-(2-methylquinolin-4-yl)-2-phenylethanamine
CID 105084872

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine?
The IUPAC name of 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine (CID 63562253) is 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine.
What is the SMILES notation for 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine?
The canonical SMILES for 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine is CCCNC(CC)C(C)c1cc(C)nc2ccccc12.
What is the InChIKey of 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine?
The InChIKey is WZFMHGGJKKGLND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-5-11-19-17(6-2)14(4)16-12-13(3)20-18-10-8-7-9-15(16)18/h7-10,12,14,17,19H,5-6,11H2,1-4H3.
What are the key properties of 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine?
2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine has a molecular weight of 270.42 g/mol, XLogP of 4.42, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine is sourced from PubChem (CID 63562253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).