3,5-dibromo-N-cyclopropylpyridin-4-amine

C8H8Br2N2 — CID 130831793

IUPAC3,5-dibromo-N-cyclopropylpyridin-4-amine
SMILESBrc1cncc(Br)c1NC1CC1
InChIInChI=1S/C8H8Br2N2/c9-6-3-11-4-7(10)8(6)12-5-1-2-5/h3-5H,1-2H2,(H,11,12)
InChIKeyKMXAPQIEFIQQCH-UHFFFAOYSA-N
MW291.97 g/mol
LogP3.18
Rot. Bonds2

About 3,5-dibromo-N-cyclopropylpyridin-4-amine

3,5-dibromo-N-cyclopropylpyridin-4-amine (PubChem CID 130831793) has the molecular formula C8H8Br2N2 and a molecular weight of 291.97 g/mol. Its IUPAC name is 3,5-dibromo-N-cyclopropylpyridin-4-amine.

Molecular Properties

Compound Name3,5-dibromo-N-cyclopropylpyridin-4-amine
PubChem CID130831793
Molecular FormulaC8H8Br2N2
Molecular Weight291.97 g/mol
Exact Mass289.91
IUPAC Name3,5-dibromo-N-cyclopropylpyridin-4-amine
SMILESBrc1cncc(Br)c1NC1CC1
InChIInChI=1S/C8H8Br2N2/c9-6-3-11-4-7(10)8(6)12-5-1-2-5/h3-5H,1-2H2,(H,11,12)
InChIKeyKMXAPQIEFIQQCH-UHFFFAOYSA-N
XLogP3.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.97
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-cyclopropylpyridin-4-amine?
The IUPAC name of 3,5-dibromo-N-cyclopropylpyridin-4-amine (CID 130831793) is 3,5-dibromo-N-cyclopropylpyridin-4-amine.
What is the SMILES notation for 3,5-dibromo-N-cyclopropylpyridin-4-amine?
The canonical SMILES for 3,5-dibromo-N-cyclopropylpyridin-4-amine is Brc1cncc(Br)c1NC1CC1.
What is the InChIKey of 3,5-dibromo-N-cyclopropylpyridin-4-amine?
The InChIKey is KMXAPQIEFIQQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Br2N2/c9-6-3-11-4-7(10)8(6)12-5-1-2-5/h3-5H,1-2H2,(H,11,12).
What are the key properties of 3,5-dibromo-N-cyclopropylpyridin-4-amine?
3,5-dibromo-N-cyclopropylpyridin-4-amine has a molecular weight of 291.97 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-cyclopropylpyridin-4-amine is sourced from PubChem (CID 130831793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).