1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine

C15H18BrN3 — CID 116784942

IUPAC1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine
SMILESCC1CC(N)CCN1c1cccc2cc(Br)cnc12
InChIInChI=1S/C15H18BrN3/c1-10-7-13(17)5-6-19(10)14-4-2-3-11-8-12(16)9-18-15(11)14/h2-4,8-10,13H,5-7,17H2,1H3
InChIKeyKGFDDSVALRKDKV-UHFFFAOYSA-N
MW320.23 g/mol
LogP3.31
Rot. Bonds1

About 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine

1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine (PubChem CID 116784942) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine
PubChem CID116784942
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine
SMILESCC1CC(N)CCN1c1cccc2cc(Br)cnc12
InChIInChI=1S/C15H18BrN3/c1-10-7-13(17)5-6-19(10)14-4-2-3-11-8-12(16)9-18-15(11)14/h2-4,8-10,13H,5-7,17H2,1H3
InChIKeyKGFDDSVALRKDKV-UHFFFAOYSA-N
XLogP3.31
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-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-(5-bromopyrimidin-2-yl)-2-methylpiperidin-4-amine
CID 115313485
3-amino-1-(3-bromoquinolin-8-yl)piperidin-2-one
CID 116785604
3-bromo-8-(2-ethyl-5-methylpiperazin-1-yl)quinoline
CID 116785676
1-(3-bromoquinolin-8-yl)-3-methyl-1,4-diazepane-2,5-dione
CID 116785723
2-methyl-1-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidin-4-amine
CID 54975723
1-(3-bromoquinolin-8-yl)-N-cyclopropylpyrrolidin-3-amine
CID 116785617
N-[[1-(3-bromoquinolin-8-yl)pyrrolidin-3-yl]methyl]cyclopropanamine
CID 116784963
3-bromo-8-(2-methylazepan-1-yl)quinolin-5-amine
CID 106949404
1-(3-bromoquinolin-8-yl)imidazolidin-2-one
CID 116784875
3-(3-bromoquinolin-8-yl)imidazolidine-2,4-dione
CID 107841893
2-(4-amino-2-methylpiperidin-1-yl)benzamide
CID 115313422
6-(4-amino-2-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 115313380

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine?
The IUPAC name of 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine (CID 116784942) is 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine.
What is the SMILES notation for 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine?
The canonical SMILES for 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine is CC1CC(N)CCN1c1cccc2cc(Br)cnc12.
What is the InChIKey of 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine?
The InChIKey is KGFDDSVALRKDKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3/c1-10-7-13(17)5-6-19(10)14-4-2-3-11-8-12(16)9-18-15(11)14/h2-4,8-10,13H,5-7,17H2,1H3.
What are the key properties of 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine?
1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine has a molecular weight of 320.23 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromoquinolin-8-yl)-2-methylpiperidin-4-amine is sourced from PubChem (CID 116784942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).