6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine

C16H20BrN3O — CID 63971710

IUPAC6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine
SMILESCOCC1CCN(c2c(N)cnc3ccc(Br)cc23)CC1
InChIInChI=1S/C16H20BrN3O/c1-21-10-11-4-6-20(7-5-11)16-13-8-12(17)2-3-15(13)19-9-14(16)18/h2-3,8-9,11H,4-7,10,18H2,1H3
InChIKeyPVRCZYHCIIODJO-UHFFFAOYSA-N
MW350.26 g/mol
LogP3.44
Rot. Bonds3

About 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine

6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine (PubChem CID 63971710) has the molecular formula C16H20BrN3O and a molecular weight of 350.26 g/mol. Its IUPAC name is 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine.

Molecular Properties

Compound Name6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine
PubChem CID63971710
Molecular FormulaC16H20BrN3O
Molecular Weight350.26 g/mol
Exact Mass349.08
IUPAC Name6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine
SMILESCOCC1CCN(c2c(N)cnc3ccc(Br)cc23)CC1
InChIInChI=1S/C16H20BrN3O/c1-21-10-11-4-6-20(7-5-11)16-13-8-12(17)2-3-15(13)19-9-14(16)18/h2-3,8-9,11H,4-7,10,18H2,1H3
InChIKeyPVRCZYHCIIODJO-UHFFFAOYSA-N
XLogP3.44
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.26
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]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

[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol
CID 43621280
6-bromo-4-(3-methoxypyrrolidin-1-yl)quinolin-3-amine
CID 103530492
6-bromo-4-(4-methylazepan-1-yl)quinolin-3-amine
CID 63624085
6-bromo-4-pyrrolidin-1-ylquinolin-3-amine
CID 43621123
1-[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]ethanol
CID 106835353
4-[3-(methoxymethyl)pyrrolidin-1-yl]quinolin-3-amine
CID 103963369
6-bromo-4-(3-methoxy-3-methylpiperidin-1-yl)quinolin-3-amine
CID 107390554
6-bromo-4-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]quinolin-3-amine
CID 81450399
6-bromo-4-N-(cyclobutylmethyl)-4-N-methylquinoline-3,4-diamine
CID 55125947
1-[6-bromo-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]quinolin-3-yl]ethanone
CID 66715820
2-[1-(6-bromo-3-methylsulfonylquinolin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine
CID 66715268
6-bromo-4-N,4-N-bis(2-methoxyethyl)quinoline-3,4-diamine
CID 43621365

Frequently Asked Questions

What is the IUPAC name of 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine?
The IUPAC name of 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine (CID 63971710) is 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine.
What is the SMILES notation for 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine?
The canonical SMILES for 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine is COCC1CCN(c2c(N)cnc3ccc(Br)cc23)CC1.
What is the InChIKey of 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine?
The InChIKey is PVRCZYHCIIODJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20BrN3O/c1-21-10-11-4-6-20(7-5-11)16-13-8-12(17)2-3-15(13)19-9-14(16)18/h2-3,8-9,11H,4-7,10,18H2,1H3.
What are the key properties of 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine?
6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine has a molecular weight of 350.26 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine is sourced from PubChem (CID 63971710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).