(3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine

C9H11BrN2O — CID 141286392

IUPAC(3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine
SMILESN[C@@H]1Cc2ccc(Br)cc2N(O)C1
InChIInChI=1S/C9H11BrN2O/c10-7-2-1-6-3-8(11)5-12(13)9(6)4-7/h1-2,4,8,13H,3,5,11H2/t8-/m1/s1
InChIKeyVPQXCGQAZTXABU-MRVPVSSYSA-N
MW243.10 g/mol
LogP1.53
Rot. Bonds

About (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine

(3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine (PubChem CID 141286392) has the molecular formula C9H11BrN2O and a molecular weight of 243.10 g/mol. Its IUPAC name is (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine.

Molecular Properties

Compound Name(3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine
PubChem CID141286392
Molecular FormulaC9H11BrN2O
Molecular Weight243.10 g/mol
Exact Mass242.01
IUPAC Name(3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine
SMILESN[C@@H]1Cc2ccc(Br)cc2N(O)C1
InChIInChI=1S/C9H11BrN2O/c10-7-2-1-6-3-8(11)5-12(13)9(6)4-7/h1-2,4,8,13H,3,5,11H2/t8-/m1/s1
InChIKeyVPQXCGQAZTXABU-MRVPVSSYSA-N
XLogP1.53
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.10
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine
CID 56971695
5-bromo-2,3-dihydro-1H-inden-2-amine
CID 11298795
(2S)-7-bromo-1,2,3,4-tetrahydronaphthalen-2-amine
CID 86326564
tert-butyl 3-amino-6-bromo-3,4-dihydro-2H-quinoline-1-carboxylate
CID 83764303
6-bromo-1-hydroxy-3H-indol-2-one
CID 70160286
(3S)-3-amino-6-bromo-1-hydroxy-3,4-dihydroquinolin-2-one
CID 130606580
4-bromo-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)aniline
CID 65342629
1-(5-bromo-2-fluorophenyl)piperidin-4-amine
CID 43555767
6-bromo-3,4-dihydro-2H-thiochromen-3-amine
CID 53408397
1-(2-amino-5-bromophenyl)-4-(bromomethyl)pyrrolidin-2-one
CID 168505649
6-bromo-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-amine
CID 18177091
1-(2,4-dibromophenyl)piperidin-4-amine
CID 61474438

Frequently Asked Questions

What is the IUPAC name of (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine?
The IUPAC name of (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine (CID 141286392) is (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine.
What is the SMILES notation for (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine?
The canonical SMILES for (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine is N[C@@H]1Cc2ccc(Br)cc2N(O)C1.
What is the InChIKey of (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine?
The InChIKey is VPQXCGQAZTXABU-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H11BrN2O/c10-7-2-1-6-3-8(11)5-12(13)9(6)4-7/h1-2,4,8,13H,3,5,11H2/t8-/m1/s1.
What are the key properties of (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine?
(3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine has a molecular weight of 243.10 g/mol, XLogP of 1.53, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-7-bromo-1-hydroxy-3,4-dihydro-2H-quinolin-3-amine is sourced from PubChem (CID 141286392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).