2-tert-butyl-8-methyl-N-propylquinolin-4-amine

C17H24N2 — CID 63481487

IUPAC2-tert-butyl-8-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C(C)(C)C)nc2c(C)cccc12
InChIInChI=1S/C17H24N2/c1-6-10-18-14-11-15(17(3,4)5)19-16-12(2)8-7-9-13(14)16/h7-9,11H,6,10H2,1-5H3,(H,18,19)
InChIKeyBSXGBHCWQJDBJR-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.66
Rot. Bonds3

About 2-tert-butyl-8-methyl-N-propylquinolin-4-amine

2-tert-butyl-8-methyl-N-propylquinolin-4-amine (PubChem CID 63481487) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-tert-butyl-8-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name2-tert-butyl-8-methyl-N-propylquinolin-4-amine
PubChem CID63481487
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name2-tert-butyl-8-methyl-N-propylquinolin-4-amine
SMILESCCCNc1cc(C(C)(C)C)nc2c(C)cccc12
InChIInChI=1S/C17H24N2/c1-6-10-18-14-11-15(17(3,4)5)19-16-12(2)8-7-9-13(14)16/h7-9,11H,6,10H2,1-5H3,(H,18,19)
InChIKeyBSXGBHCWQJDBJR-UHFFFAOYSA-N
XLogP4.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-8-methyl-N-propylquinolin-4-amine
CID 63481626
2-tert-butyl-4,8-dimethylquinoline
CID 59432974
2-cyclopropyl-8-methyl-N-propylquinolin-4-amine
CID 63358059
2-tert-butyl-7,8-dichloro-N-propylquinolin-4-amine
CID 63479601
8-bromo-2-tert-butyl-6-methyl-N-propylquinolin-4-amine
CID 63480755
8-iodo-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 55194221
2-tert-butyl-N-ethyl-8-propoxyquinolin-4-amine
CID 63481575
2-methyl-4-(propylamino)quinolin-8-ol
CID 45097479
2-tert-butyl-6-ethyl-N-propylquinolin-4-amine
CID 63479725
5-bromo-2-tert-butyl-6-fluoro-8-methyl-N-propylquinolin-4-amine
CID 107593976
8-(methoxymethyl)-2-methyl-N-propylquinolin-4-amine
CID 62197742
2-tert-butyl-6-methoxy-N-propylquinolin-4-amine
CID 63481474

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-8-methyl-N-propylquinolin-4-amine?
The IUPAC name of 2-tert-butyl-8-methyl-N-propylquinolin-4-amine (CID 63481487) is 2-tert-butyl-8-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 2-tert-butyl-8-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 2-tert-butyl-8-methyl-N-propylquinolin-4-amine is CCCNc1cc(C(C)(C)C)nc2c(C)cccc12.
What is the InChIKey of 2-tert-butyl-8-methyl-N-propylquinolin-4-amine?
The InChIKey is BSXGBHCWQJDBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-6-10-18-14-11-15(17(3,4)5)19-16-12(2)8-7-9-13(14)16/h7-9,11H,6,10H2,1-5H3,(H,18,19).
What are the key properties of 2-tert-butyl-8-methyl-N-propylquinolin-4-amine?
2-tert-butyl-8-methyl-N-propylquinolin-4-amine has a molecular weight of 256.39 g/mol, XLogP of 4.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-8-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 63481487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).