4-(3-methylbutan-2-yloxy)quinolin-3-amine

C14H18N2O — CID 113359457

IUPAC4-(3-methylbutan-2-yloxy)quinolin-3-amine
SMILESCC(C)C(C)Oc1c(N)cnc2ccccc12
InChIInChI=1S/C14H18N2O/c1-9(2)10(3)17-14-11-6-4-5-7-13(11)16-8-12(14)15/h4-10H,15H2,1-3H3
InChIKeyYIGCGMDUSVNESJ-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.24
Rot. Bonds3

About 4-(3-methylbutan-2-yloxy)quinolin-3-amine

4-(3-methylbutan-2-yloxy)quinolin-3-amine (PubChem CID 113359457) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 4-(3-methylbutan-2-yloxy)quinolin-3-amine.

Molecular Properties

Compound Name4-(3-methylbutan-2-yloxy)quinolin-3-amine
PubChem CID113359457
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name4-(3-methylbutan-2-yloxy)quinolin-3-amine
SMILESCC(C)C(C)Oc1c(N)cnc2ccccc12
InChIInChI=1S/C14H18N2O/c1-9(2)10(3)17-14-11-6-4-5-7-13(11)16-8-12(14)15/h4-10H,15H2,1-3H3
InChIKeyYIGCGMDUSVNESJ-UHFFFAOYSA-N
XLogP3.24
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(3-methylbutan-2-yloxy)quinolin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(1,1,1-trifluoropropan-2-yloxy)quinolin-3-amine
CID 113359456
1-(3-aminoquinolin-4-yl)ethanol
CID 118547425
4-[3-(dimethylamino)propoxy]quinolin-3-amine
CID 103963698
4-cyclobutyloxyquinolin-3-amine
CID 103963709
4-(2-ethylhexoxy)quinolin-3-amine
CID 103963670
4-(4-methylsulfanylphenoxy)quinolin-3-amine
CID 103963721
(4-propan-2-yloxyquinolin-3-yl)methanamine
CID 43669459
4-(2-butoxyethoxy)quinolin-3-amine
CID 103963666
4-(difluoromethyl)quinolin-3-amine
CID 178080175
(2S)-2-[(3-aminoquinolin-4-yl)amino]-3-methylbutan-1-ol
CID 114982592
4-(4-bromo-2-methylphenoxy)quinolin-3-amine
CID 103963717
4-(4-bromo-3-methylphenoxy)quinolin-3-amine
CID 103963762

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylbutan-2-yloxy)quinolin-3-amine?
The IUPAC name of 4-(3-methylbutan-2-yloxy)quinolin-3-amine (CID 113359457) is 4-(3-methylbutan-2-yloxy)quinolin-3-amine.
What is the SMILES notation for 4-(3-methylbutan-2-yloxy)quinolin-3-amine?
The canonical SMILES for 4-(3-methylbutan-2-yloxy)quinolin-3-amine is CC(C)C(C)Oc1c(N)cnc2ccccc12.
What is the InChIKey of 4-(3-methylbutan-2-yloxy)quinolin-3-amine?
The InChIKey is YIGCGMDUSVNESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-9(2)10(3)17-14-11-6-4-5-7-13(11)16-8-12(14)15/h4-10H,15H2,1-3H3.
What are the key properties of 4-(3-methylbutan-2-yloxy)quinolin-3-amine?
4-(3-methylbutan-2-yloxy)quinolin-3-amine has a molecular weight of 230.31 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylbutan-2-yloxy)quinolin-3-amine is sourced from PubChem (CID 113359457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).