3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine

C13H21BrN2 — CID 105367831

IUPAC3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine
SMILESCc1cnc(N(C)C(C)CC(C)C)c(Br)c1
InChIInChI=1S/C13H21BrN2/c1-9(2)6-11(4)16(5)13-12(14)7-10(3)8-15-13/h7-9,11H,6H2,1-5H3
InChIKeyGDULNRYUSHFCMH-UHFFFAOYSA-N
MW285.23 g/mol
LogP4.02
Rot. Bonds4

About 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine

3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine (PubChem CID 105367831) has the molecular formula C13H21BrN2 and a molecular weight of 285.23 g/mol. Its IUPAC name is 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine
PubChem CID105367831
Molecular FormulaC13H21BrN2
Molecular Weight285.23 g/mol
Exact Mass284.09
IUPAC Name3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine
SMILESCc1cnc(N(C)C(C)CC(C)C)c(Br)c1
InChIInChI=1S/C13H21BrN2/c1-9(2)6-11(4)16(5)13-12(14)7-10(3)8-15-13/h7-9,11H,6H2,1-5H3
InChIKeyGDULNRYUSHFCMH-UHFFFAOYSA-N
XLogP4.02
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.23
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-5-chloro-N-methyl-N-(4-methylpentan-2-yl)pyridin-2-amine
CID 114836921
5-(bromomethyl)-N,3-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine
CID 107081935
2-N,3-dimethyl-2-N-(4-methylpentan-2-yl)pyridine-2,5-diamine
CID 62477075
3-bromo-N-(3-bromopropyl)-5-methyl-N-propan-2-ylpyridin-2-amine
CID 105368755
[5-methyl-6-[methyl(4-methylpentan-2-yl)amino]-3-pyridinyl]methanol
CID 80628806
3-bromo-N-[1-(2-fluorophenyl)ethyl]-N,5-dimethylpyridin-2-amine
CID 105367909
3-bromo-N-(1-bromopropan-2-yl)-5-chloro-N-methylpyridin-2-amine
CID 114838597
5-bromo-N-methyl-N-(4-methylpentan-2-yl)pyrimidin-2-amine
CID 63872878
3-bromo-N-[1-(3-chlorophenyl)ethyl]-N,5-dimethylpyridin-2-amine
CID 105367908
N'-(3-bromo-5-methyl-2-pyridinyl)-N'-methyl-N-propylethane-1,2-diamine
CID 105368619
5-bromo-N-methyl-N-(4-methylpentan-2-yl)pyridin-3-amine
CID 115657240
3-bromo-N-cyclohexyl-N,5-dimethylpyridin-2-amine
CID 105367626

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine?
The IUPAC name of 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine (CID 105367831) is 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine?
The canonical SMILES for 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine is Cc1cnc(N(C)C(C)CC(C)C)c(Br)c1.
What is the InChIKey of 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine?
The InChIKey is GDULNRYUSHFCMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21BrN2/c1-9(2)6-11(4)16(5)13-12(14)7-10(3)8-15-13/h7-9,11H,6H2,1-5H3.
What are the key properties of 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine?
3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine has a molecular weight of 285.23 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N,5-dimethyl-N-(4-methylpentan-2-yl)pyridin-2-amine is sourced from PubChem (CID 105367831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).