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

C11H16BrClN2 — CID 114835656

IUPAC3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine
SMILESCC(C)CC(C)Nc1ncc(Cl)cc1Br
InChIInChI=1S/C11H16BrClN2/c1-7(2)4-8(3)15-11-10(12)5-9(13)6-14-11/h5-8H,4H2,1-3H3,(H,14,15)
InChIKeyUPNQZWPULWDFGU-UHFFFAOYSA-N
MW291.62 g/mol
LogP4.34
Rot. Bonds4

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

3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine (PubChem CID 114835656) has the molecular formula C11H16BrClN2 and a molecular weight of 291.62 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine
PubChem CID114835656
Molecular FormulaC11H16BrClN2
Molecular Weight291.62 g/mol
Exact Mass290.02
IUPAC Name3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine
SMILESCC(C)CC(C)Nc1ncc(Cl)cc1Br
InChIInChI=1S/C11H16BrClN2/c1-7(2)4-8(3)15-11-10(12)5-9(13)6-14-11/h5-8H,4H2,1-3H3,(H,14,15)
InChIKeyUPNQZWPULWDFGU-UHFFFAOYSA-N
XLogP4.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.62
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-bromo-5-chloro-2-pyridinyl)amino]propan-1-ol
CID 114835661
3-bromo-5-chloro-N-(1-chloro-4-methylpentan-2-yl)pyridin-2-amine
CID 114838487
3-bromo-5-chloro-N-(6-methylheptan-2-yl)pyridin-2-amine
CID 114835786
2-N-(3-bromo-5-chloro-2-pyridinyl)-4-methylpentane-1,2-diamine
CID 114836303
5-chloro-3-fluoro-N-(4-methylpentan-2-yl)pyridin-2-amine
CID 79728229
3-bromo-5-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine
CID 114835785
3-bromo-N-but-3-en-2-yl-5-chloropyridin-2-amine
CID 114836115
3-bromo-5-chloro-N-ethylpyridin-2-amine
CID 114835594
2-[(3-bromo-5-chloro-2-pyridinyl)amino]propanamide
CID 114835671
3-bromo-5-chloro-N-methylpyridin-2-amine
CID 51356623
ethyl 2-[(3-bromo-5-chloro-2-pyridinyl)amino]propanoate
CID 114835797
3-bromo-5-chloro-N-(3-chloro-2-methylpropyl)pyridin-2-amine
CID 114838511

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine?
The IUPAC name of 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine (CID 114835656) is 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine?
The canonical SMILES for 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine is CC(C)CC(C)Nc1ncc(Cl)cc1Br.
What is the InChIKey of 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine?
The InChIKey is UPNQZWPULWDFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrClN2/c1-7(2)4-8(3)15-11-10(12)5-9(13)6-14-11/h5-8H,4H2,1-3H3,(H,14,15).
What are the key properties of 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine?
3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine has a molecular weight of 291.62 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-N-(4-methylpentan-2-yl)pyridin-2-amine is sourced from PubChem (CID 114835656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).