N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C19H22N4O — CID 24716800

IUPACN-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCc1cc(C(=O)NCc2ccccc2)nc2cc(C(C)(C)C)nn12
InChIInChI=1S/C19H22N4O/c1-13-10-15(18(24)20-12-14-8-6-5-7-9-14)21-17-11-16(19(2,3)4)22-23(13)17/h5-11H,12H2,1-4H3,(H,20,24)
InChIKeyNGYFMPSCBGVHTJ-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.27
Rot. Bonds3

About N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide

N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 24716800) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID24716800
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC NameN-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCc1cc(C(=O)NCc2ccccc2)nc2cc(C(C)(C)C)nn12
InChIInChI=1S/C19H22N4O/c1-13-10-15(18(24)20-12-14-8-6-5-7-9-14)21-17-11-16(19(2,3)4)22-23(13)17/h5-11H,12H2,1-4H3,(H,20,24)
InChIKeyNGYFMPSCBGVHTJ-UHFFFAOYSA-N
XLogP3.27
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-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

7-methyl-2-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 42877265
2,7-dimethyl-N-(pyridin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110851998
N-benzyl-6-(4-tert-butylanilino)-2-methylpyrimidine-4-carboxamide
CID 109368433
N-[2-(dimethylamino)ethyl]-7-methyl-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 24716905
N-[(4-methoxyphenyl)methyl]-7-methyl-5-phenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3860137
N-(furan-2-ylmethyl)-7-methyl-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 46079602
N-tert-butyl-7-methyl-2-phenylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 24716804
7-methyl-N-[(3-methylphenyl)methyl]pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 110850843
N-[(4-fluorophenyl)methyl]-7-methyl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040500
N-benzyl-7-ethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040792
N-benzyl-4-methylquinoline-2-carboxamide
CID 164678694
N-benzyl-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 1172225

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 24716800) is N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide is Cc1cc(C(=O)NCc2ccccc2)nc2cc(C(C)(C)C)nn12.
What is the InChIKey of N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is NGYFMPSCBGVHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-13-10-15(18(24)20-12-14-8-6-5-7-9-14)21-17-11-16(19(2,3)4)22-23(13)17/h5-11H,12H2,1-4H3,(H,20,24).
What are the key properties of N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-tert-butyl-7-methylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 24716800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).