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

C11H17BrN2 — CID 64599178

IUPAC3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine
SMILESCC(C)C(C)CNc1ncccc1Br
InChIInChI=1S/C11H17BrN2/c1-8(2)9(3)7-14-11-10(12)5-4-6-13-11/h4-6,8-9H,7H2,1-3H3,(H,13,14)
InChIKeyZWWYPEIZQQVZCH-UHFFFAOYSA-N
MW257.17 g/mol
LogP3.55
Rot. Bonds4

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

3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine (PubChem CID 64599178) has the molecular formula C11H17BrN2 and a molecular weight of 257.17 g/mol. Its IUPAC name is 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine
PubChem CID64599178
Molecular FormulaC11H17BrN2
Molecular Weight257.17 g/mol
Exact Mass256.06
IUPAC Name3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine
SMILESCC(C)C(C)CNc1ncccc1Br
InChIInChI=1S/C11H17BrN2/c1-8(2)9(3)7-14-11-10(12)5-4-6-13-11/h4-6,8-9H,7H2,1-3H3,(H,13,14)
InChIKeyZWWYPEIZQQVZCH-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 ≤ 500257.17
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-(2,3-dimethylbutyl)-4-methylpyridin-2-amine
CID 106875769
5-[(3-bromo-2-pyridinyl)amino]pentan-2-ol
CID 106128835
3-bromo-N-(3-methylbut-2-enyl)pyridin-2-amine
CID 106191508
3-[(3-bromo-2-pyridinyl)amino]-2-hydroxypropanamide
CID 106170853
N-(3-bromo-2-pyridinyl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 62642737
3-bromo-N-butan-2-ylpyridin-2-amine
CID 61374838
2-[(3-bromo-2-pyridinyl)amino]ethanol
CID 61374645
3-bromo-N-(3-chloropropyl)pyridin-2-amine
CID 65029830
N-benzyl-3-bromopyridin-2-amine
CID 11708714
3-[(3-bromo-2-pyridinyl)amino]-4-methylpentan-1-ol
CID 106350440
N-(2,3-dimethylbutyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104731641
3-bromo-N-(4-chlorobutyl)pyridin-2-amine
CID 86240809

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
The IUPAC name of 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine (CID 64599178) is 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine is CC(C)C(C)CNc1ncccc1Br.
What is the InChIKey of 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
The InChIKey is ZWWYPEIZQQVZCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN2/c1-8(2)9(3)7-14-11-10(12)5-4-6-13-11/h4-6,8-9H,7H2,1-3H3,(H,13,14).
What are the key properties of 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine?
3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine has a molecular weight of 257.17 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 3-bromo-N-(2,3-dimethylbutyl)pyridin-2-amine is sourced from PubChem (CID 64599178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).