7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine

C7H7BrN4 — CID 169113953

IUPAC7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine
SMILESCNc1ncc(Br)c2[nH]ncc12
InChIInChI=1S/C7H7BrN4/c1-9-7-4-2-11-12-6(4)5(8)3-10-7/h2-3H,1H3,(H,9,10)(H,11,12)
InChIKeyGHXRRJZGAKUYDK-UHFFFAOYSA-N
MW227.06 g/mol
LogP1.76
Rot. Bonds1

About 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine

7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine (PubChem CID 169113953) has the molecular formula C7H7BrN4 and a molecular weight of 227.06 g/mol. Its IUPAC name is 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound Name7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine
PubChem CID169113953
Molecular FormulaC7H7BrN4
Molecular Weight227.06 g/mol
Exact Mass225.99
IUPAC Name7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine
SMILESCNc1ncc(Br)c2[nH]ncc12
InChIInChI=1S/C7H7BrN4/c1-9-7-4-2-11-12-6(4)5(8)3-10-7/h2-3H,1H3,(H,9,10)(H,11,12)
InChIKeyGHXRRJZGAKUYDK-UHFFFAOYSA-N
XLogP1.76
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.06
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine?
The IUPAC name of 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine (CID 169113953) is 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine.
What is the SMILES notation for 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine?
The canonical SMILES for 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine is CNc1ncc(Br)c2[nH]ncc12.
What is the InChIKey of 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine?
The InChIKey is GHXRRJZGAKUYDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrN4/c1-9-7-4-2-11-12-6(4)5(8)3-10-7/h2-3H,1H3,(H,9,10)(H,11,12).
What are the key properties of 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine?
7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine has a molecular weight of 227.06 g/mol, XLogP of 1.76, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-methyl-1H-pyrazolo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 169113953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).