N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine

C15H17BrN2 — CID 779150

IUPACN-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine
SMILESCN(CCc1ccccn1)Cc1ccccc1Br
InChIInChI=1S/C15H17BrN2/c1-18(11-9-14-7-4-5-10-17-14)12-13-6-2-3-8-15(13)16/h2-8,10H,9,11-12H2,1H3
InChIKeyCMZTYWYSNXZRLS-UHFFFAOYSA-N
MW305.22 g/mol
LogP3.52
Rot. Bonds5

About N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine

N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine (PubChem CID 779150) has the molecular formula C15H17BrN2 and a molecular weight of 305.22 g/mol. Its IUPAC name is N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine
PubChem CID779150
Molecular FormulaC15H17BrN2
Molecular Weight305.22 g/mol
Exact Mass304.06
IUPAC NameN-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine
SMILESCN(CCc1ccccn1)Cc1ccccc1Br
InChIInChI=1S/C15H17BrN2/c1-18(11-9-14-7-4-5-10-17-14)12-13-6-2-3-8-15(13)16/h2-8,10H,9,11-12H2,1H3
InChIKeyCMZTYWYSNXZRLS-UHFFFAOYSA-N
XLogP3.52
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.22
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5-bromo-3-pyridinyl)methyl]-N-methyl-2-pyridin-2-ylethanamine
CID 115877394
N-methyl-2-pyridin-2-yl-N-(pyridin-2-ylmethyl)ethanamine;oxalic acid
CID 2845946
N-methyl-2-pyridin-2-yl-N-(pyridin-3-ylmethyl)ethanamine
CID 2055754
4-chloro-2,6-bis[[methyl(2-pyridin-2-ylethyl)amino]methyl]phenol
CID 139202506
N-[(2-bromophenyl)methyl]-N-(pyridin-2-ylmethyl)ethanamine
CID 78942264
N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
N-[(2-bromophenyl)methyl]-N-methylpropan-1-amine
CID 60776921
N-benzyl-N-methyl-2-pyridin-2-ylethanamine;oxalic acid
CID 17384893
2-bromo-N-methyl-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 47104193
N-methyl-2-pyridin-2-yl-N-(1,2,3,4-tetrahydroisoquinolin-5-ylmethyl)ethanamine
CID 104557278
N-methyl-2-pyridin-2-yl-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine
CID 662771
N-methyl-2-pyridin-2-yl-N-[(4-trimethylsilylphenyl)methyl]ethanamine
CID 103438267

Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine?
The IUPAC name of N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine (CID 779150) is N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine.
What is the SMILES notation for N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine?
The canonical SMILES for N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine is CN(CCc1ccccn1)Cc1ccccc1Br.
What is the InChIKey of N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine?
The InChIKey is CMZTYWYSNXZRLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2/c1-18(11-9-14-7-4-5-10-17-14)12-13-6-2-3-8-15(13)16/h2-8,10H,9,11-12H2,1H3.
What are the key properties of N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine?
N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine has a molecular weight of 305.22 g/mol, XLogP of 3.52, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methyl]-N-methyl-2-pyridin-2-ylethanamine is sourced from PubChem (CID 779150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).