N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine

C17H24N2 — CID 82245549

IUPACN-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine
SMILESCNCCCc1cc2cccc(C(C)C)c2nc1C
InChIInChI=1S/C17H24N2/c1-12(2)16-9-5-7-15-11-14(8-6-10-18-4)13(3)19-17(15)16/h5,7,9,11-12,18H,6,8,10H2,1-4H3
InChIKeyLWQONEZLKTVKLL-UHFFFAOYSA-N
MW256.39 g/mol
LogP3.82
Rot. Bonds5

About N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine

N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine (PubChem CID 82245549) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine
PubChem CID82245549
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC NameN-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine
SMILESCNCCCc1cc2cccc(C(C)C)c2nc1C
InChIInChI=1S/C17H24N2/c1-12(2)16-9-5-7-15-11-14(8-6-10-18-4)13(3)19-17(15)16/h5,7,9,11-12,18H,6,8,10H2,1-4H3
InChIKeyLWQONEZLKTVKLL-UHFFFAOYSA-N
XLogP3.82
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 ≤ 53.82
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-(6-fluoro-2-methylquinolin-3-yl)-N-methylpropan-1-amine
CID 82242928
3-(2-chloroquinolin-3-yl)-N-methylpropan-1-amine
CID 116985191
N-methyl-3-quinolin-8-ylpropan-1-amine
CID 70598005
2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine
CID 82242686
N-methyl-1-(8-propan-2-ylquinolin-3-yl)methanamine
CID 82241794
4-propan-2-ylacridine
CID 87209750
1-(8-chloro-2-methylquinolin-3-yl)-N-methylmethanamine
CID 82242197
3,8-di(propan-2-yl)quinolin-2-amine
CID 63231952
1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine
CID 70253087
3-(8-butoxy-2-methylquinolin-3-yl)propan-1-amine
CID 82247731
3-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-N-methylpropan-1-amine
CID 95452248
N-methyl-3-propan-2-yl-8-propylquinolin-2-amine
CID 63524556

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine?
The IUPAC name of N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine (CID 82245549) is N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine.
What is the SMILES notation for N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine?
The canonical SMILES for N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine is CNCCCc1cc2cccc(C(C)C)c2nc1C.
What is the InChIKey of N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine?
The InChIKey is LWQONEZLKTVKLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-12(2)16-9-5-7-15-11-14(8-6-10-18-4)13(3)19-17(15)16/h5,7,9,11-12,18H,6,8,10H2,1-4H3.
What are the key properties of N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine?
N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine has a molecular weight of 256.39 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-methyl-8-propan-2-ylquinolin-3-yl)propan-1-amine is sourced from PubChem (CID 82245549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).