5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine

C12H10BrClN2 — CID 103583115

IUPAC5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine
SMILESCN(c1ccccc1)c1ncc(Br)cc1Cl
InChIInChI=1S/C12H10BrClN2/c1-16(10-5-3-2-4-6-10)12-11(14)7-9(13)8-15-12/h2-8H,1H3
InChIKeyINVNIMCMCABYNZ-UHFFFAOYSA-N
MW297.58 g/mol
LogP4.27
Rot. Bonds2

About 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine

5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine (PubChem CID 103583115) has the molecular formula C12H10BrClN2 and a molecular weight of 297.58 g/mol. Its IUPAC name is 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine
PubChem CID103583115
Molecular FormulaC12H10BrClN2
Molecular Weight297.58 g/mol
Exact Mass295.97
IUPAC Name5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine
SMILESCN(c1ccccc1)c1ncc(Br)cc1Cl
InChIInChI=1S/C12H10BrClN2/c1-16(10-5-3-2-4-6-10)12-11(14)7-9(13)8-15-12/h2-8H,1H3
InChIKeyINVNIMCMCABYNZ-UHFFFAOYSA-N
XLogP4.27
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.58
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-3-chloro-N-(4-methoxyphenyl)-N-methylpyridin-2-amine
CID 103583292
4-[(5-bromo-3-chloro-2-pyridinyl)-methylamino]-N'-hydroxybenzenecarboximidamide
CID 103582321
2-[(5-bromo-3-chloro-2-pyridinyl)-methylamino]benzenecarboximidamide
CID 103582344
5-bromo-3-chloro-N-cyclobutyl-N-methylpyridin-2-amine
CID 103580299
5-bromo-3-chloro-N-[(3-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 103583219
5-bromo-N-(2-bromoethyl)-3-chloro-N-propan-2-ylpyridin-2-amine
CID 103584128
5-bromo-3-chloro-N-ethyl-N-(2-methylphenyl)pyridin-2-amine
CID 103583130
5-bromo-3-chloro-N-methyl-N-(oxan-4-yl)pyridin-2-amine
CID 103580325
2-[(5-bromo-3-chloro-2-pyridinyl)oxy]phenol
CID 103582945
5-bromo-N,3-dimethyl-N-naphthalen-2-ylpyridin-2-amine
CID 115148547
3,5-dichloro-N-(4-methoxyphenyl)-N-methylpyridin-2-amine
CID 70584896
3,4-dichloro-N-methyl-N-phenylaniline
CID 73012191

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine?
The IUPAC name of 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine (CID 103583115) is 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine is CN(c1ccccc1)c1ncc(Br)cc1Cl.
What is the InChIKey of 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine?
The InChIKey is INVNIMCMCABYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrClN2/c1-16(10-5-3-2-4-6-10)12-11(14)7-9(13)8-15-12/h2-8H,1H3.
What are the key properties of 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine?
5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine has a molecular weight of 297.58 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N-methyl-N-phenylpyridin-2-amine is sourced from PubChem (CID 103583115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).