5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine

C11H17BrN2 — CID 64597766

IUPAC5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine
SMILESCC(C)C(C)CNc1ccc(Br)cn1
InChIInChI=1S/C11H17BrN2/c1-8(2)9(3)6-13-11-5-4-10(12)7-14-11/h4-5,7-9H,6H2,1-3H3,(H,13,14)
InChIKeyZVUBAUSPFQYKFW-UHFFFAOYSA-N
MW257.18 g/mol
LogP3.55
Rot. Bonds4

About 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine

5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine (PubChem CID 64597766) has the molecular formula C11H17BrN2 and a molecular weight of 257.18 g/mol. Its IUPAC name is 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine
PubChem CID64597766
Molecular FormulaC11H17BrN2
Molecular Weight257.18 g/mol
Exact Mass256.06
IUPAC Name5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine
SMILESCC(C)C(C)CNc1ccc(Br)cn1
InChIInChI=1S/C11H17BrN2/c1-8(2)9(3)6-13-11-5-4-10(12)7-14-11/h4-5,7-9H,6H2,1-3H3,(H,13,14)
InChIKeyZVUBAUSPFQYKFW-UHFFFAOYSA-N
XLogP3.55
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.18
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-pyridinyl)-N',2-dimethylpropane-1,3-diamine
CID 115303018
N-(2,3-dimethylbutyl)-5-fluoropyridin-2-amine
CID 64597559
2-N-(2,3-dimethylbutyl)pyridine-2,5-diamine
CID 64570407
5-bromo-N-(2-ethoxypropyl)pyridin-2-amine
CID 115658186
5-bromo-N-[2-(4-methoxyphenoxy)propyl]pyridin-2-amine
CID 133323967
5-bromo-N-[2-(2-methoxyphenoxy)propyl]pyridin-2-amine
CID 133324265
5-bromo-N-(3-methylpentan-2-yl)pyridin-2-amine
CID 61463582
5-bromo-N-(2,3-dimethylbutyl)pyridine-2-carboxamide
CID 64596698
2-[(5-bromo-2-pyridinyl)amino]-3-methylbutan-1-ol
CID 79249750
[3-[(5-bromo-2-pyridinyl)amino]-2-methylpropyl]-tert-butylcarbamic acid
CID 155099118
N'-(5-bromo-2-pyridinyl)-N-propylethane-1,2-diamine
CID 62662670
5-tert-butyl-N-(2,3,3-trimethylbutyl)pyridin-2-amine
CID 107874830

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
The IUPAC name of 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine (CID 64597766) is 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine is CC(C)C(C)CNc1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
The InChIKey is ZVUBAUSPFQYKFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN2/c1-8(2)9(3)6-13-11-5-4-10(12)7-14-11/h4-5,7-9H,6H2,1-3H3,(H,13,14).
What are the key properties of 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine has a molecular weight of 257.18 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine is sourced from PubChem (CID 64597766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).