5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline

C14H15BrN2 — CID 43729519

IUPAC5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline
SMILESCc1ccc(Br)cc1NC(C)c1ccccn1
InChIInChI=1S/C14H15BrN2/c1-10-6-7-12(15)9-14(10)17-11(2)13-5-3-4-8-16-13/h3-9,11,17H,1-2H3
InChIKeyGKOBLSBIVLYVQO-UHFFFAOYSA-N
MW291.19 g/mol
LogP4.33
Rot. Bonds3

About 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline

5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline (PubChem CID 43729519) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline.

Molecular Properties

Compound Name5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline
PubChem CID43729519
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline
SMILESCc1ccc(Br)cc1NC(C)c1ccccn1
InChIInChI=1S/C14H15BrN2/c1-10-6-7-12(15)9-14(10)17-11(2)13-5-3-4-8-16-13/h3-9,11,17H,1-2H3
InChIKeyGKOBLSBIVLYVQO-UHFFFAOYSA-N
XLogP4.33
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline 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

2,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43196549
3-bromo-N-(1-pyridin-2-ylethyl)aniline
CID 43194583
3,5-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43195401
5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)benzenesulfonamide
CID 17410002
5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)benzamide
CID 65307460
2,3-dimethyl-N-(1-pyridin-2-ylethyl)aniline
CID 43196433
4-bromo-2,5-difluoro-N-(1-pyridin-2-ylethyl)aniline
CID 107609858
4-methyl-1-N-(1-pyridin-2-ylethyl)benzene-1,2-diamine
CID 43524351
5-bromo-N-[1-(2-methoxyphenyl)ethyl]-2-methylaniline
CID 43729543
3-methyl-4-(1-pyridin-2-ylethylamino)benzonitrile
CID 60929772
5-bromo-2-methyl-N-(1-thiophen-2-ylethyl)aniline
CID 43729607
5-methyl-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 115922253

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline?
The IUPAC name of 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline (CID 43729519) is 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline.
What is the SMILES notation for 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline?
The canonical SMILES for 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline is Cc1ccc(Br)cc1NC(C)c1ccccn1.
What is the InChIKey of 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline?
The InChIKey is GKOBLSBIVLYVQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c1-10-6-7-12(15)9-14(10)17-11(2)13-5-3-4-8-16-13/h3-9,11,17H,1-2H3.
What are the key properties of 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline?
5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline has a molecular weight of 291.19 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methyl-N-(1-pyridin-2-ylethyl)aniline is sourced from PubChem (CID 43729519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).