4-[(2-bromophenyl)methoxy]pyridin-3-amine

C12H11BrN2O — CID 82828460

IUPAC4-[(2-bromophenyl)methoxy]pyridin-3-amine
SMILESNc1cnccc1OCc1ccccc1Br
InChIInChI=1S/C12H11BrN2O/c13-10-4-2-1-3-9(10)8-16-12-5-6-15-7-11(12)14/h1-7H,8,14H2
InChIKeyXHONEMSCBCQWNH-UHFFFAOYSA-N
MW279.14 g/mol
LogP3.01
Rot. Bonds3

About 4-[(2-bromophenyl)methoxy]pyridin-3-amine

4-[(2-bromophenyl)methoxy]pyridin-3-amine (PubChem CID 82828460) has the molecular formula C12H11BrN2O and a molecular weight of 279.14 g/mol. Its IUPAC name is 4-[(2-bromophenyl)methoxy]pyridin-3-amine.

Molecular Properties

Compound Name4-[(2-bromophenyl)methoxy]pyridin-3-amine
PubChem CID82828460
Molecular FormulaC12H11BrN2O
Molecular Weight279.14 g/mol
Exact Mass278.01
IUPAC Name4-[(2-bromophenyl)methoxy]pyridin-3-amine
SMILESNc1cnccc1OCc1ccccc1Br
InChIInChI=1S/C12H11BrN2O/c13-10-4-2-1-3-9(10)8-16-12-5-6-15-7-11(12)14/h1-7H,8,14H2
InChIKeyXHONEMSCBCQWNH-UHFFFAOYSA-N
XLogP3.01
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.14
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[(2-bromophenyl)methoxy]pyridin-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

2-[(2-bromophenyl)methoxy]aniline
CID 11208190
3-bromo-4-[(2-bromophenyl)methoxy]aniline
CID 82827730
4-N-[(2-bromophenyl)methyl]-4-N-methylpyridine-3,4-diamine
CID 61358641
N-[[3-[(2-bromophenyl)methoxy]-4-pyridinyl]methyl]propan-2-amine
CID 105075920
4-[(2-bromophenyl)methoxy]-2,5-dimethylaniline
CID 55158064
2-[(3-amino-4-pyridinyl)methoxy]phenol
CID 105469628
2-[(2-bromophenyl)methoxy]-4-methylaniline
CID 24691550
3-[(2-bromophenyl)methoxy]-4-methylaniline
CID 43520223
3-bromo-8-[(2-bromophenyl)methoxy]quinolin-5-amine
CID 106949907
3-amino-4-[(2-bromophenyl)methoxy]benzoic acid
CID 43379750
3-(naphthalen-1-ylmethoxy)pyridin-4-amine
CID 10422219
6-[(2-bromophenyl)methoxy]-5-methylpyridin-3-amine
CID 82827886

Frequently Asked Questions

What is the IUPAC name of 4-[(2-bromophenyl)methoxy]pyridin-3-amine?
The IUPAC name of 4-[(2-bromophenyl)methoxy]pyridin-3-amine (CID 82828460) is 4-[(2-bromophenyl)methoxy]pyridin-3-amine.
What is the SMILES notation for 4-[(2-bromophenyl)methoxy]pyridin-3-amine?
The canonical SMILES for 4-[(2-bromophenyl)methoxy]pyridin-3-amine is Nc1cnccc1OCc1ccccc1Br.
What is the InChIKey of 4-[(2-bromophenyl)methoxy]pyridin-3-amine?
The InChIKey is XHONEMSCBCQWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2O/c13-10-4-2-1-3-9(10)8-16-12-5-6-15-7-11(12)14/h1-7H,8,14H2.
What are the key properties of 4-[(2-bromophenyl)methoxy]pyridin-3-amine?
4-[(2-bromophenyl)methoxy]pyridin-3-amine has a molecular weight of 279.14 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-bromophenyl)methoxy]pyridin-3-amine is sourced from PubChem (CID 82828460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).