7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

C19H22N8O — CID 19441267

IUPAC7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCCn1ncc(-c2ccnc3cc(C(=O)N(C)Cc4ccn(C)n4)nn23)c1C
InChIInChI=1S/C19H22N8O/c1-5-26-13(2)15(11-21-26)17-6-8-20-18-10-16(23-27(17)18)19(28)24(3)12-14-7-9-25(4)22-14/h6-11H,5,12H2,1-4H3
InChIKeyWTNBGSOLYNKENC-UHFFFAOYSA-N
MW378.44 g/mol
LogP1.93
Rot. Bonds5

About 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 19441267) has the molecular formula C19H22N8O and a molecular weight of 378.44 g/mol. Its IUPAC name is 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID19441267
Molecular FormulaC19H22N8O
Molecular Weight378.44 g/mol
Exact Mass378.19
IUPAC Name7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCCn1ncc(-c2ccnc3cc(C(=O)N(C)Cc4ccn(C)n4)nn23)c1C
InChIInChI=1S/C19H22N8O/c1-5-26-13(2)15(11-21-26)17-6-8-20-18-10-16(23-27(17)18)19(28)24(3)12-14-7-9-25(4)22-14/h6-11H,5,12H2,1-4H3
InChIKeyWTNBGSOLYNKENC-UHFFFAOYSA-N
XLogP1.93
TPSA86.14 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.44
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19441266
7-(1-ethyl-5-methylpyrazol-4-yl)-N-[(1-ethylpyrazol-4-yl)methyl]-N-methylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19441256
7-(1-ethyl-5-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 4776201
N-[3-(dimethylamino)propyl]-7-(1-ethyl-5-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19468764
7-(1-ethyl-5-methylpyrazol-4-yl)-N-(2-sulfanylethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19468755
methyl 2-[[7-(1-ethyl-5-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]acetate
CID 19414314
7-(4-bromo-1-ethylpyrazol-3-yl)-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-methylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19441233
N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-7-(1-ethyl-5-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19468807
N-cyclohexyl-7-(1-ethyl-5-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19468763
N,5-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19440913
dimethyl 5-[[7-(1-ethyl-5-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]benzene-1,3-dicarboxylate
CID 19468661
ethyl 1-methyl-3-[methyl-[(1-methylpyrazol-3-yl)methyl]carbamoyl]pyrazole-5-carboxylate
CID 19278164

Frequently Asked Questions

What is the IUPAC name of 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 19441267) is 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is CCn1ncc(-c2ccnc3cc(C(=O)N(C)Cc4ccn(C)n4)nn23)c1C.
What is the InChIKey of 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is WTNBGSOLYNKENC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N8O/c1-5-26-13(2)15(11-21-26)17-6-8-20-18-10-16(23-27(17)18)19(28)24(3)12-14-7-9-25(4)22-14/h6-11H,5,12H2,1-4H3.
What are the key properties of 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 378.44 g/mol, XLogP of 1.93, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-ethyl-5-methylpyrazol-4-yl)-N-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 19441267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).