2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol

C13H15BrN2O — CID 132590349

IUPAC2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol
SMILESCc1c(N)c(C(C)(C)O)nc2ccc(Br)cc12
InChIInChI=1S/C13H15BrN2O/c1-7-9-6-8(14)4-5-10(9)16-12(11(7)15)13(2,3)17/h4-6,17H,15H2,1-3H3
InChIKeyKAORZFPGSSDLAV-UHFFFAOYSA-N
MW295.18 g/mol
LogP3.12
Rot. Bonds1

About 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol

2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol (PubChem CID 132590349) has the molecular formula C13H15BrN2O and a molecular weight of 295.18 g/mol. Its IUPAC name is 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol
PubChem CID132590349
Molecular FormulaC13H15BrN2O
Molecular Weight295.18 g/mol
Exact Mass294.04
IUPAC Name2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol
SMILESCc1c(N)c(C(C)(C)O)nc2ccc(Br)cc12
InChIInChI=1S/C13H15BrN2O/c1-7-9-6-8(14)4-5-10(9)16-12(11(7)15)13(2,3)17/h4-6,17H,15H2,1-3H3
InChIKeyKAORZFPGSSDLAV-UHFFFAOYSA-N
XLogP3.12
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.18
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-amino-6-bromo-4-methylquinolin-2-yl)pentan-3-ol
CID 132590355
3-(3-amino-6-bromo-4-phenylquinolin-2-yl)pentan-3-ol
CID 132590342
6-bromo-2-tert-butylquinolin-4-amine
CID 62196775
2-(1-amino-6-bromo-4-propan-2-ylisoquinolin-3-yl)propan-2-ol
CID 177334855
2-(3,4-diamino-6,7-dimethylquinolin-2-yl)propan-2-ol
CID 142558003
1-(4-amino-8-bromoimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
CID 69080714
6-bromo-2,3-dimethylquinoline-4-carbothioamide
CID 71390196
6-bromo-2-propan-2-ylquinolin-4-amine
CID 62196777
6-bromo-2,3-dimethylquinoline-4-carboxylic acid
CID 43829324
2-(2-amino-4-bromophenyl)propan-2-ol
CID 57155706
4-amino-6-bromoquinoline-3-carboxylic acid
CID 46397798
6-bromo-4-chloroquinolin-2-amine
CID 154853425

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol?
The IUPAC name of 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol (CID 132590349) is 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol.
What is the SMILES notation for 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol?
The canonical SMILES for 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol is Cc1c(N)c(C(C)(C)O)nc2ccc(Br)cc12.
What is the InChIKey of 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol?
The InChIKey is KAORZFPGSSDLAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2O/c1-7-9-6-8(14)4-5-10(9)16-12(11(7)15)13(2,3)17/h4-6,17H,15H2,1-3H3.
What are the key properties of 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol?
2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol has a molecular weight of 295.18 g/mol, XLogP of 3.12, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-6-bromo-4-methylquinolin-2-yl)propan-2-ol is sourced from PubChem (CID 132590349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).