[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol

C15H18BrN3O — CID 43621280

IUPAC[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol
SMILESNc1cnc2ccc(Br)cc2c1N1CCC(CO)CC1
InChIInChI=1S/C15H18BrN3O/c16-11-1-2-14-12(7-11)15(13(17)8-18-14)19-5-3-10(9-20)4-6-19/h1-2,7-8,10,20H,3-6,9,17H2
InChIKeyNXBAMWFUESEOEQ-UHFFFAOYSA-N
MW336.23 g/mol
LogP2.79
Rot. Bonds2

About [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol

[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol (PubChem CID 43621280) has the molecular formula C15H18BrN3O and a molecular weight of 336.23 g/mol. Its IUPAC name is [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol
PubChem CID43621280
Molecular FormulaC15H18BrN3O
Molecular Weight336.23 g/mol
Exact Mass335.06
IUPAC Name[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol
SMILESNc1cnc2ccc(Br)cc2c1N1CCC(CO)CC1
InChIInChI=1S/C15H18BrN3O/c16-11-1-2-14-12(7-11)15(13(17)8-18-14)19-5-3-10(9-20)4-6-19/h1-2,7-8,10,20H,3-6,9,17H2
InChIKeyNXBAMWFUESEOEQ-UHFFFAOYSA-N
XLogP2.79
TPSA62.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.23
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-4-[4-(methoxymethyl)piperidin-1-yl]quinolin-3-amine
CID 63971710
1-[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]ethanol
CID 106835353
6-bromo-4-pyrrolidin-1-ylquinolin-3-amine
CID 43621123
6-bromo-4-(4-methylazepan-1-yl)quinolin-3-amine
CID 63624085
6-bromo-4-(3-methoxypyrrolidin-1-yl)quinolin-3-amine
CID 103530492
1-[6-bromo-4-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]quinolin-3-yl]ethanone
CID 66715820
6-bromo-4-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]quinolin-3-amine
CID 81450399
2-[1-(6-bromo-3-methylsulfonylquinolin-4-yl)piperidin-4-yl]-N,N-dimethylethanamine
CID 66715268
6-bromo-4-(3-methoxy-3-methylpiperidin-1-yl)quinolin-3-amine
CID 107390554
6-bromo-4-N-(cyclobutylmethyl)-4-N-methylquinoline-3,4-diamine
CID 55125947
[1-(6-bromoquinolin-4-yl)piperidin-3-yl]methanol
CID 67476126
[1-(2-amino-5-bromopyrimidin-4-yl)piperidin-4-yl]methanol
CID 80756578

Frequently Asked Questions

What is the IUPAC name of [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol?
The IUPAC name of [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol (CID 43621280) is [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol is Nc1cnc2ccc(Br)cc2c1N1CCC(CO)CC1.
What is the InChIKey of [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol?
The InChIKey is NXBAMWFUESEOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3O/c16-11-1-2-14-12(7-11)15(13(17)8-18-14)19-5-3-10(9-20)4-6-19/h1-2,7-8,10,20H,3-6,9,17H2.
What are the key properties of [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol?
[1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol has a molecular weight of 336.23 g/mol, XLogP of 2.79, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-amino-6-bromoquinolin-4-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 43621280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).