6-methoxy-3-propan-2-ylquinolin-2-amine

C13H16N2O — CID 63232081

IUPAC6-methoxy-3-propan-2-ylquinolin-2-amine
SMILESCOc1ccc2nc(N)c(C(C)C)cc2c1
InChIInChI=1S/C13H16N2O/c1-8(2)11-7-9-6-10(16-3)4-5-12(9)15-13(11)14/h4-8H,1-3H3,(H2,14,15)
InChIKeyVVIPKBKTPHEGSW-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.95
Rot. Bonds2

About 6-methoxy-3-propan-2-ylquinolin-2-amine

6-methoxy-3-propan-2-ylquinolin-2-amine (PubChem CID 63232081) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 6-methoxy-3-propan-2-ylquinolin-2-amine.

Molecular Properties

Compound Name6-methoxy-3-propan-2-ylquinolin-2-amine
PubChem CID63232081
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name6-methoxy-3-propan-2-ylquinolin-2-amine
SMILESCOc1ccc2nc(N)c(C(C)C)cc2c1
InChIInChI=1S/C13H16N2O/c1-8(2)11-7-9-6-10(16-3)4-5-12(9)15-13(11)14/h4-8H,1-3H3,(H2,14,15)
InChIKeyVVIPKBKTPHEGSW-UHFFFAOYSA-N
XLogP2.95
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-3-propan-2-ylquinolin-2-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

6-phenyl-3-propan-2-ylquinolin-2-amine
CID 63231770
3,6-dimethoxy-2-propan-2-ylnaphthalene
CID 71390395
ethane;6-methoxy-3-propan-2-ylnaphthalen-2-ol
CID 143419787
1-(2-chloro-6-methoxyquinolin-3-yl)-3-sulfanylpropane-1,2-diol
CID 170821236
1-ethenyl-4-methoxy-2-propan-2-ylbenzene
CID 22712642
3-fluoro-6-methoxy-2-methylquinoline
CID 89223203
1-(2-chloro-6-methoxyquinolin-3-yl)pentan-1-ol
CID 132776082
2-butan-2-yl-6-methoxyquinoline
CID 142826325
(6-methoxyquinolin-2-yl)methanamine;dihydrochloride
CID 47002728
3-bromo-7-methoxyquinolin-2-amine
CID 126637777
2-(2,6-dimethoxyquinolin-3-yl)ethanamine
CID 170868890
2-chloro-6-methoxy-3-propylquinoline
CID 63231530

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-propan-2-ylquinolin-2-amine?
The IUPAC name of 6-methoxy-3-propan-2-ylquinolin-2-amine (CID 63232081) is 6-methoxy-3-propan-2-ylquinolin-2-amine.
What is the SMILES notation for 6-methoxy-3-propan-2-ylquinolin-2-amine?
The canonical SMILES for 6-methoxy-3-propan-2-ylquinolin-2-amine is COc1ccc2nc(N)c(C(C)C)cc2c1.
What is the InChIKey of 6-methoxy-3-propan-2-ylquinolin-2-amine?
The InChIKey is VVIPKBKTPHEGSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-8(2)11-7-9-6-10(16-3)4-5-12(9)15-13(11)14/h4-8H,1-3H3,(H2,14,15).
What are the key properties of 6-methoxy-3-propan-2-ylquinolin-2-amine?
6-methoxy-3-propan-2-ylquinolin-2-amine has a molecular weight of 216.28 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-propan-2-ylquinolin-2-amine is sourced from PubChem (CID 63232081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).