3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine

C11H15BrN2 — CID 106875940

IUPAC3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine
SMILESCc1ccnc(NC2(C)CCC2)c1Br
InChIInChI=1S/C11H15BrN2/c1-8-4-7-13-10(9(8)12)14-11(2)5-3-6-11/h4,7H,3,5-6H2,1-2H3,(H,13,14)
InChIKeyFPAUWQIHQXPELL-UHFFFAOYSA-N
MW255.16 g/mol
LogP3.51
Rot. Bonds2

About 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine

3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine (PubChem CID 106875940) has the molecular formula C11H15BrN2 and a molecular weight of 255.16 g/mol. Its IUPAC name is 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine
PubChem CID106875940
Molecular FormulaC11H15BrN2
Molecular Weight255.16 g/mol
Exact Mass254.04
IUPAC Name3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine
SMILESCc1ccnc(NC2(C)CCC2)c1Br
InChIInChI=1S/C11H15BrN2/c1-8-4-7-13-10(9(8)12)14-11(2)5-3-6-11/h4,7H,3,5-6H2,1-2H3,(H,13,14)
InChIKeyFPAUWQIHQXPELL-UHFFFAOYSA-N
XLogP3.51
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.16
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-[1-(chloromethyl)cyclopentyl]-4-methylpyridin-2-amine
CID 106878934
3-bromo-N-cyclopropyl-4-methylpyridin-2-amine
CID 97181175
3-bromo-4-methyl-N-[(1-methylsulfanylcyclohexyl)methyl]pyridin-2-amine
CID 114117198
3-bromo-N-tert-butyl-4-methylpyridin-2-amine
CID 106876455
3-bromo-N-(3-chloro-2,2-dimethylcyclobutyl)-4-methylpyridin-2-amine
CID 106879069
3-bromo-4-methyl-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridin-2-amine
CID 106875830
3-bromo-4-methyl-N-(3-methylbutan-2-yl)pyridin-2-amine
CID 106875473
2-[(1-methylcyclobutyl)amino]pyridine-3-carbonitrile
CID 115765447
3-N-(1-methylcyclohexyl)pyrazine-2,3-diamine
CID 102985894
3-bromo-N-(2,3-dimethylcyclohexyl)-4-methylpyridin-2-amine
CID 106875451
3-bromo-N-(1-cyclopropylethyl)-4-methylpyridin-2-amine
CID 106875494
3-bromo-4-methyl-N-(2,3,4,5,6-pentafluorophenyl)pyridin-2-amine
CID 106877354

Frequently Asked Questions

What is the IUPAC name of 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine?
The IUPAC name of 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine (CID 106875940) is 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine is Cc1ccnc(NC2(C)CCC2)c1Br.
What is the InChIKey of 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine?
The InChIKey is FPAUWQIHQXPELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2/c1-8-4-7-13-10(9(8)12)14-11(2)5-3-6-11/h4,7H,3,5-6H2,1-2H3,(H,13,14).
What are the key properties of 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine?
3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine has a molecular weight of 255.16 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-4-methyl-N-(1-methylcyclobutyl)pyridin-2-amine is sourced from PubChem (CID 106875940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).