N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine

C17H24N2 — CID 82448231

IUPACN-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine
SMILESCCc1ccc2nc(C)cc(CNC(C)CC)c2c1
InChIInChI=1S/C17H24N2/c1-5-12(3)18-11-15-9-13(4)19-17-8-7-14(6-2)10-16(15)17/h7-10,12,18H,5-6,11H2,1-4H3
InChIKeyQMMZJONETOSZJG-UHFFFAOYSA-N
MW256.39 g/mol
LogP3.99
Rot. Bonds5

About N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine

N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine (PubChem CID 82448231) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine.

Molecular Properties

Compound NameN-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine
PubChem CID82448231
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC NameN-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine
SMILESCCc1ccc2nc(C)cc(CNC(C)CC)c2c1
InChIInChI=1S/C17H24N2/c1-5-12(3)18-11-15-9-13(4)19-17-8-7-14(6-2)10-16(15)17/h7-10,12,18H,5-6,11H2,1-4H3
InChIKeyQMMZJONETOSZJG-UHFFFAOYSA-N
XLogP3.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(6-bromo-2-methylquinolin-4-yl)methyl]butan-2-amine
CID 82449064
N-[(6-ethyl-2-methylquinolin-4-yl)methyl]-2-methylpropan-1-amine
CID 82448230
N-[(6-ethyl-2-methylquinolin-4-yl)methyl]cyclopentanamine
CID 82448232
2-methyl-N-[(2-methylquinolin-4-yl)methyl]pentan-3-amine
CID 78942769
5-methyl-N-[(2-methylquinolin-4-yl)methyl]hexan-2-amine
CID 78942763
4-(6-ethyl-2-methylquinolin-4-yl)butan-1-amine
CID 82577783
N-[(7,8-dichloro-2-methylquinolin-4-yl)methyl]butan-2-amine
CID 82449312
N-[(8-bromo-2-methylquinolin-4-yl)methyl]butan-2-amine
CID 82449013
3-[(2-methylquinolin-4-yl)methylamino]butan-1-ol
CID 78998387
(6-ethyl-2-methylquinolin-4-yl)hydrazine
CID 17040004
N-[(8-methoxy-2-methylquinolin-4-yl)methyl]butan-2-amine
CID 82449656
N-[(2-methylquinolin-4-yl)methyl]-1-pyrazol-1-ylpropan-2-amine
CID 78943040

Frequently Asked Questions

What is the IUPAC name of N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine?
The IUPAC name of N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine (CID 82448231) is N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine.
What is the SMILES notation for N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine?
The canonical SMILES for N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine is CCc1ccc2nc(C)cc(CNC(C)CC)c2c1.
What is the InChIKey of N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine?
The InChIKey is QMMZJONETOSZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-5-12(3)18-11-15-9-13(4)19-17-8-7-14(6-2)10-16(15)17/h7-10,12,18H,5-6,11H2,1-4H3.
What are the key properties of N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine?
N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine has a molecular weight of 256.39 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-ethyl-2-methylquinolin-4-yl)methyl]butan-2-amine is sourced from PubChem (CID 82448231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).