6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide

C7H5BrN4O — CID 3094292

IUPAC6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESNC(=O)c1cc2ncc(Br)cn2n1
InChIInChI=1S/C7H5BrN4O/c8-4-2-10-6-1-5(7(9)13)11-12(6)3-4/h1-3H,(H2,9,13)
InChIKeyIPFCJCPRFNTSIT-UHFFFAOYSA-N
MW241.05 g/mol
LogP0.59
Rot. Bonds1

About 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide

6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 3094292) has the molecular formula C7H5BrN4O and a molecular weight of 241.05 g/mol. Its IUPAC name is 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID3094292
Molecular FormulaC7H5BrN4O
Molecular Weight241.05 g/mol
Exact Mass239.96
IUPAC Name6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESNC(=O)c1cc2ncc(Br)cn2n1
InChIInChI=1S/C7H5BrN4O/c8-4-2-10-6-1-5(7(9)13)11-12(6)3-4/h1-3H,(H2,9,13)
InChIKeyIPFCJCPRFNTSIT-UHFFFAOYSA-N
XLogP0.59
TPSA73.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.05
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(6-Bromo-pyrazolo[1,5-a]pyrimidine-2-carbonyl)-3,4,5,6,7,8-hexahydro-thiazolo[4,5-d]azepin-2-one
CID 71748063
6-bromo-3-chloro-N-propylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3094293
(6-Bromopyrazolo[1,5-a]pyrimidin-2-yl)-morpholin-4-ylmethanone
CID 689338
3,6-dibromo-N-butylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3094294
(6-Bromopyrazolo[1,5-a]pyrimidin-2-yl)-piperidin-1-ylmethanone
CID 2842282
N-allyl-3-chloropyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 2171634
3,6-dibromo-N-propylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 1733312
2-Methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 1478930
6-bromo-N-(2-methoxyethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 2237560
6-(6-Bromo-pyrazolo[1,5-a]pyrimidine-2-carbonyl)-3-methyl-3,4,5,6,7,8-hexahydro-thiazolo[4,5-d]azepin-2-one
CID 71748083
N-[(8-oxo-7,8a-dihydro-1H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-7-carboxamide
CID 169423319
(6-Bromopyrazolo[1,5-a]pyrimidin-2-yl)(2-ethylpiperidin-1-yl)methanone
CID 2981648

Frequently Asked Questions

What is the IUPAC name of 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 3094292) is 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide is NC(=O)c1cc2ncc(Br)cn2n1.
What is the InChIKey of 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is IPFCJCPRFNTSIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrN4O/c8-4-2-10-6-1-5(7(9)13)11-12(6)3-4/h1-3H,(H2,9,13).
What are the key properties of 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide?
6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 241.05 g/mol, XLogP of 0.59, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromopyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 3094292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).