5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine

C14H21BrN2 — CID 114869260

IUPAC5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine
SMILESCc1cc(NC(C)C2CCCCC2)ncc1Br
InChIInChI=1S/C14H21BrN2/c1-10-8-14(16-9-13(10)15)17-11(2)12-6-4-3-5-7-12/h8-9,11-12H,3-7H2,1-2H3,(H,16,17)
InChIKeyOBUSOMAMHHERFU-UHFFFAOYSA-N
MW297.24 g/mol
LogP4.53
Rot. Bonds3

About 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine

5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine (PubChem CID 114869260) has the molecular formula C14H21BrN2 and a molecular weight of 297.24 g/mol. Its IUPAC name is 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine
PubChem CID114869260
Molecular FormulaC14H21BrN2
Molecular Weight297.24 g/mol
Exact Mass296.09
IUPAC Name5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine
SMILESCc1cc(NC(C)C2CCCCC2)ncc1Br
InChIInChI=1S/C14H21BrN2/c1-10-8-14(16-9-13(10)15)17-11(2)12-6-4-3-5-7-12/h8-9,11-12H,3-7H2,1-2H3,(H,16,17)
InChIKeyOBUSOMAMHHERFU-UHFFFAOYSA-N
XLogP4.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.24
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(1-cyclopropylethyl)-4-methylpyridin-2-amine
CID 115773894
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-bromo-4-methylpyridin-2-amine
CID 114869144
3-bromo-N-(1-cyclohexylethyl)-5-methylpyridin-2-amine
CID 105366898
N-(1-cyclopentylethyl)-5-methyl-4-nitropyridin-2-amine
CID 83267136
5-chloro-N-(1-cyclohexylethyl)pyridin-2-amine
CID 62406315
5-bromo-4-methyl-N-(2-propan-2-ylcyclohexyl)pyridin-2-amine
CID 114869348
2,6-dibromo-N-(1-cyclohexylethyl)-4-methylaniline
CID 55199408
5-bromo-N-[(2S)-butan-2-yl]-4-methylpyridin-2-amine
CID 86323877
2-N-(1-cyclohexylethyl)pyridine-2,5-diamine
CID 62406978
3-bromo-N-(1-cyclohexylethyl)-4-methylaniline
CID 55192209
5-bromo-N-(1-cyclohexylethyl)-2-hydrazinylpyrimidin-4-amine
CID 80919360
5-bromo-4-methyl-N-(2-methylpentan-3-yl)pyridin-2-amine
CID 114869215

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine?
The IUPAC name of 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine (CID 114869260) is 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine is Cc1cc(NC(C)C2CCCCC2)ncc1Br.
What is the InChIKey of 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine?
The InChIKey is OBUSOMAMHHERFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21BrN2/c1-10-8-14(16-9-13(10)15)17-11(2)12-6-4-3-5-7-12/h8-9,11-12H,3-7H2,1-2H3,(H,16,17).
What are the key properties of 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine?
5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine has a molecular weight of 297.24 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1-cyclohexylethyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 114869260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).