3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine

C15H22BrN3 — CID 63683256

IUPAC3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine
SMILESCN(CC1CC2CCC1C2)c1ncc(Br)cc1CN
InChIInChI=1S/C15H22BrN3/c1-19(9-13-5-10-2-3-11(13)4-10)15-12(7-17)6-14(16)8-18-15/h6,8,10-11,13H,2-5,7,9,17H2,1H3
InChIKeyZJQYJQKHOYYRJF-UHFFFAOYSA-N
MW324.27 g/mol
LogP3.18
Rot. Bonds4

About 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine

3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine (PubChem CID 63683256) has the molecular formula C15H22BrN3 and a molecular weight of 324.27 g/mol. Its IUPAC name is 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine
PubChem CID63683256
Molecular FormulaC15H22BrN3
Molecular Weight324.27 g/mol
Exact Mass323.10
IUPAC Name3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine
SMILESCN(CC1CC2CCC1C2)c1ncc(Br)cc1CN
InChIInChI=1S/C15H22BrN3/c1-19(9-13-5-10-2-3-11(13)4-10)15-12(7-17)6-14(16)8-18-15/h6,8,10-11,13H,2-5,7,9,17H2,1H3
InChIKeyZJQYJQKHOYYRJF-UHFFFAOYSA-N
XLogP3.18
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.27
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-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

3-(aminomethyl)-5-bromo-N-(cyclobutylmethyl)-N-methylpyridin-2-amine
CID 62855860
2-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-bromo-2-N,4-dimethylpyridine-2,5-diamine
CID 104506859
4-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-bromo-2-fluoro-N-methylaniline
CID 107532386
N-(2-bicyclo[2.2.1]heptanylmethyl)-3-chloro-5-(chloromethyl)-N-methylpyridin-2-amine
CID 63681809
2-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methylaniline
CID 63687901
4-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-fluoro-N-methylaniline
CID 115366879
4-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-4-N-methyl-2-N-propylpyrimidine-2,4-diamine
CID 80818030
3-(aminomethyl)-5-bromo-N-butyl-N-methylpyridin-2-amine
CID 62299284
3-(aminomethyl)-5-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine
CID 62286034
4-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-4-N-methylpyridine-3,4-diamine
CID 103518149
2-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-N,6-dimethylaniline
CID 107105713
5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine
CID 63879585

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine (CID 63683256) is 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine is CN(CC1CC2CCC1C2)c1ncc(Br)cc1CN.
What is the InChIKey of 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine?
The InChIKey is ZJQYJQKHOYYRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22BrN3/c1-19(9-13-5-10-2-3-11(13)4-10)15-12(7-17)6-14(16)8-18-15/h6,8,10-11,13H,2-5,7,9,17H2,1H3.
What are the key properties of 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine?
3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine has a molecular weight of 324.27 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine is sourced from PubChem (CID 63683256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).