[2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine

C14H15BrN2O — CID 82827715

IUPAC[2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine
SMILESCc1ccnc(OCc2cccc(Br)c2)c1CN
InChIInChI=1S/C14H15BrN2O/c1-10-5-6-17-14(13(10)8-16)18-9-11-3-2-4-12(15)7-11/h2-7H,8-9,16H2,1H3
InChIKeyASUPHBJTVIAFGP-UHFFFAOYSA-N
MW307.19 g/mol
LogP3.19
Rot. Bonds4

About [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine

[2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine (PubChem CID 82827715) has the molecular formula C14H15BrN2O and a molecular weight of 307.19 g/mol. Its IUPAC name is [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine
PubChem CID82827715
Molecular FormulaC14H15BrN2O
Molecular Weight307.19 g/mol
Exact Mass306.04
IUPAC Name[2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine
SMILESCc1ccnc(OCc2cccc(Br)c2)c1CN
InChIInChI=1S/C14H15BrN2O/c1-10-5-6-17-14(13(10)8-16)18-9-11-3-2-4-12(15)7-11/h2-7H,8-9,16H2,1H3
InChIKeyASUPHBJTVIAFGP-UHFFFAOYSA-N
XLogP3.19
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.19
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine 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-[(3-bromophenyl)methoxy]-3-pyridinyl]methanamine
CID 82828121
2-[(3-bromophenyl)methoxy]-3-chloro-5,6-dimethylpyrazine
CID 82824481
2-[(3-bromophenyl)methoxy]-5-methylpyridin-4-amine
CID 83270095
[3-[(5-bromo-2-methylphenoxy)methyl]phenyl]methanamine
CID 107283560
N-[[2-[(3-bromophenyl)methoxy]-3-pyridinyl]methyl]ethanamine
CID 82831306
N-[[2-[(3-bromophenyl)methoxy]-3-pyridinyl]methyl]propan-2-amine
CID 82832222
6-[(3-bromophenyl)methoxy]-N-ethyl-5-propylpyrimidin-4-amine
CID 82807487
[4-[(3-bromophenyl)methoxy]-3,5-dimethoxyphenyl]methanamine
CID 60889253
[3-[(3-bromophenyl)methoxymethyl]phenyl]methanamine
CID 82827520
6-[(3-bromophenyl)methoxy]-5-ethyl-N-propylpyrimidin-4-amine
CID 82808541
3-[(3-bromophenyl)methoxy]-2-methylaniline
CID 43437900
7-bromo-1-phenylmethoxyisoquinoline
CID 86710700

Frequently Asked Questions

What is the IUPAC name of [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine?
The IUPAC name of [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine (CID 82827715) is [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine.
What is the SMILES notation for [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine?
The canonical SMILES for [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine is Cc1ccnc(OCc2cccc(Br)c2)c1CN.
What is the InChIKey of [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine?
The InChIKey is ASUPHBJTVIAFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2O/c1-10-5-6-17-14(13(10)8-16)18-9-11-3-2-4-12(15)7-11/h2-7H,8-9,16H2,1H3.
What are the key properties of [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine?
[2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine has a molecular weight of 307.19 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-bromophenyl)methoxy]-4-methyl-3-pyridinyl]methanamine is sourced from PubChem (CID 82827715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).