1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine

C17H24N2 — CID 55162398

IUPAC1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine
SMILESCCCNC(CC)Cc1cc(C)nc2ccccc12
InChIInChI=1S/C17H24N2/c1-4-10-18-15(5-2)12-14-11-13(3)19-17-9-7-6-8-16(14)17/h6-9,11,15,18H,4-5,10,12H2,1-3H3
InChIKeyRUSXUPNABYHPBC-UHFFFAOYSA-N
MW256.39 g/mol
LogP3.86
Rot. Bonds6

About 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine

1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine (PubChem CID 55162398) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine.

Molecular Properties

Compound Name1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine
PubChem CID55162398
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine
SMILESCCCNC(CC)Cc1cc(C)nc2ccccc12
InChIInChI=1S/C17H24N2/c1-4-10-18-15(5-2)12-14-11-13(3)19-17-9-7-6-8-16(14)17/h6-9,11,15,18H,4-5,10,12H2,1-3H3
InChIKeyRUSXUPNABYHPBC-UHFFFAOYSA-N
XLogP3.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-bromobutyl)-2-methylquinoline
CID 63203840
2-(2-methylquinolin-4-yl)-N-propylpentan-3-amine
CID 63562253
2-methyl-N-[(2-methylquinolin-4-yl)methyl]pentan-3-amine
CID 78942769
3-methyl-1-(2-methylquinolin-4-yl)butan-2-ol
CID 63205399
N-ethyl-N'-[(2-methylquinolin-4-yl)methyl]ethane-1,2-diamine
CID 113405208
4-(2-chloro-3,3-dimethylbutyl)-2-methylquinoline
CID 63530701
(E)-3-methyl-4-(2-methylquinolin-4-yl)-N-propylbut-3-en-2-amine
CID 103093547
1-N,1-N-dimethyl-2-N-propyl-3-quinolin-4-ylpropane-1,2-diamine
CID 79093124
4-hexyl-2-methylquinoline
CID 12861362
(2-methylquinolin-4-yl)methanethiol
CID 79885955
3-(2-methylquinolin-4-yl)-2-sulfanylpropanoic acid
CID 79235361
4-methylsulfanyl-N-propyl-1-quinolin-4-ylbutan-2-amine
CID 105159278

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine?
The IUPAC name of 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine (CID 55162398) is 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine.
What is the SMILES notation for 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine?
The canonical SMILES for 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine is CCCNC(CC)Cc1cc(C)nc2ccccc12.
What is the InChIKey of 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine?
The InChIKey is RUSXUPNABYHPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-4-10-18-15(5-2)12-14-11-13(3)19-17-9-7-6-8-16(14)17/h6-9,11,15,18H,4-5,10,12H2,1-3H3.
What are the key properties of 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine?
1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine has a molecular weight of 256.39 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylquinolin-4-yl)-N-propylbutan-2-amine is sourced from PubChem (CID 55162398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).