5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine

C11H16BrN3 — CID 63879585

IUPAC5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine
SMILESCC1CC1CN(C)c1ncc(Br)cc1N
InChIInChI=1S/C11H16BrN3/c1-7-3-8(7)6-15(2)11-10(13)4-9(12)5-14-11/h4-5,7-8H,3,6,13H2,1-2H3
InChIKeyHRSLGTUZXPBOGU-UHFFFAOYSA-N
MW270.17 g/mol
LogP2.52
Rot. Bonds3

About 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine

5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine (PubChem CID 63879585) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine.

Molecular Properties

Compound Name5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine
PubChem CID63879585
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine
SMILESCC1CC1CN(C)c1ncc(Br)cc1N
InChIInChI=1S/C11H16BrN3/c1-7-3-8(7)6-15(2)11-10(13)4-9(12)5-14-11/h4-5,7-8H,3,6,13H2,1-2H3
InChIKeyHRSLGTUZXPBOGU-UHFFFAOYSA-N
XLogP2.52
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-N-cyclopropyl-2-N-ethylpyridine-2,3-diamine
CID 61228482
N-[(3-aminocyclobutyl)methyl]-5-bromo-3-chloro-N-methylpyridin-2-amine
CID 103584238
5-bromo-2-N-cyclopentyl-2-N-methylpyridine-2,3-diamine
CID 61228674
5-bromo-2-N-(3-methoxypropyl)-2-N-methylpyridine-2,3-diamine
CID 59631539
3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-bromo-N-methylpyridin-2-amine
CID 63683256
5-bromo-2-N,4-N-dimethyl-4-N-[(2-methylcyclopropyl)methyl]pyrimidine-2,4-diamine
CID 80838183
5-bromo-2-N-(cyclobutylmethyl)-2-N-ethylpyridine-2,3-diamine
CID 107397165
5-methyl-6-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-3-carboxylic acid
CID 80631533
5-bromo-2-N-[(3-chlorophenyl)methyl]-2-N-methylpyridine-2,3-diamine
CID 61413712
4-N-methyl-4-N-[(2-methylcyclopropyl)methyl]pyrimidine-4,6-diamine
CID 80838310
3-(aminomethyl)-5-bromo-N-(cyclobutylmethyl)-N-methylpyridin-2-amine
CID 62855860
5-chloro-2-N,4-N-dimethyl-4-N-[(2-methylcyclopropyl)methyl]pyrimidine-2,4-diamine
CID 80839936

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine?
The IUPAC name of 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine (CID 63879585) is 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine.
What is the SMILES notation for 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine?
The canonical SMILES for 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine is CC1CC1CN(C)c1ncc(Br)cc1N.
What is the InChIKey of 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine?
The InChIKey is HRSLGTUZXPBOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3/c1-7-3-8(7)6-15(2)11-10(13)4-9(12)5-14-11/h4-5,7-8H,3,6,13H2,1-2H3.
What are the key properties of 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine?
5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine has a molecular weight of 270.17 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-N-methyl-2-N-[(2-methylcyclopropyl)methyl]pyridine-2,3-diamine is sourced from PubChem (CID 63879585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).