2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide

C12H16N4O — CID 49830970

IUPAC2-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCC1=NC2=CC(=NN2C(=C1)C(=O)N)C(C)(C)C
InChIInChI=1S/C12H16N4O/c1-7-5-8(11(13)17)16-10(14-7)6-9(15-16)12(2,3)4/h5-6H,1-4H3,(H2,13,17)
InChIKeyBMKHCMLGQGVJTF-UHFFFAOYSA-N
MW232.28 g/mol
LogP1.60
Rot. Bonds2

About 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide

2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide (PubChem CID 49830970) has the molecular formula C12H16N4O and a molecular weight of 232.28 g/mol. Its IUPAC name is 2-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound Name2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
PubChem CID49830970
Molecular FormulaC12H16N4O
Molecular Weight232.28 g/mol
Exact Mass232.13
IUPAC Name2-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide
SMILESCC1=NC2=CC(=NN2C(=C1)C(=O)N)C(C)(C)C
InChIInChI=1S/C12H16N4O/c1-7-5-8(11(13)17)16-10(14-7)6-9(15-16)12(2,3)4/h5-6H,1-4H3,(H2,13,17)
InChIKeyBMKHCMLGQGVJTF-UHFFFAOYSA-N
XLogP1.60
TPSA73.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity312

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-cyclopropyl-N-(3-methylpent-1-yn-3-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 4259373
N-allyl-5-cyclopropyl-7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 2243233
5-cyclopropyl-N-isobutyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 842867
5-Methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 671633
1-Ethyl-4-[7-(propan-2-YL)pyrazolo[1,5-A]pyrimidine-5-carbonyl]piperazine
CID 53040843
(7-Isopropylpyrazolo[1,5-a]pyrimidin-5-yl)(piperidino)methanone
CID 53040897
N~2~-(5-ethyl-2,3-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)-L-leucinamide
CID 56903826
N~2~-(5-isopropyl-2-methylpyrazolo[1,5-a]pyrimidin-7-yl)-L-valinamide
CID 56917124
7-Tert-butyl-N-cyclopentylpyrazolo[1,5-A]pyrimidine-5-carboxamide
CID 53040926
N-[2-tert-butyl-7-methyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]acetamide
CID 2823240
(2-Tert-butyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-piperidin-1-ylmethanone
CID 24716889
2-tert-butyl-N,N-diethyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 24717009

Frequently Asked Questions

What is the IUPAC name of 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The IUPAC name of 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide (CID 49830970) is 2-tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide.
What is the SMILES notation for 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The canonical SMILES for 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide is CC1=NC2=CC(=NN2C(=C1)C(=O)N)C(C)(C)C.
What is the InChIKey of 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
The InChIKey is BMKHCMLGQGVJTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-7-5-8(11(13)17)16-10(14-7)6-9(15-16)12(2,3)4/h5-6H,1-4H3,(H2,13,17).
What are the key properties of 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide?
2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide has a molecular weight of 232.28 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Tert-butyl-5-methylpyrazolo[1,5-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 49830970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).