6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C24H24N6O4 — CID 55871588

IUPAC6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C24H24N6O4/c1-14-17(15(2)30-23(28-14)19(13-27-30)22(25)32)9-10-21(31)29-20-8-4-3-7-18(20)24(33)26-12-16-6-5-11-34-16/h3-8,11,13H,9-10,12H2,1-2H3,(H2,25,32)(H,26,33)(H,29,31)
InChIKeyLAEFEYZMBYZTAB-UHFFFAOYSA-N
MW460.49 g/mol
LogP2.54
Rot. Bonds8

About 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 55871588) has the molecular formula C24H24N6O4 and a molecular weight of 460.49 g/mol. Its IUPAC name is 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID55871588
Molecular FormulaC24H24N6O4
Molecular Weight460.49 g/mol
Exact Mass460.19
IUPAC Name6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)Nc1ccccc1C(=O)NCc1ccco1
InChIInChI=1S/C24H24N6O4/c1-14-17(15(2)30-23(28-14)19(13-27-30)22(25)32)9-10-21(31)29-20-8-4-3-7-18(20)24(33)26-12-16-6-5-11-34-16/h3-8,11,13H,9-10,12H2,1-2H3,(H2,25,32)(H,26,33)(H,29,31)
InChIKeyLAEFEYZMBYZTAB-UHFFFAOYSA-N
XLogP2.54
TPSA144.62 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.49
LogP ≤ 52.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

6-[3-(2-iodoanilino)-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55737352
6-[3-(benzylamino)-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55737265
6-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 3396114
5,7-dimethyl-6-[3-[2-(5-methyl-1,2,4-oxadiazol-3-yl)anilino]-3-oxopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55872175
6-[3-(2,6-difluoroanilino)-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 52621976
N,N'-bis[2-(furan-2-ylmethylcarbamoyl)phenyl]hexanediamide
CID 4938791
6-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55736269
5,7-dimethyl-6-[3-[(5-methyl-1H-pyrazol-3-yl)amino]-3-oxopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56797134
2-[3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoylamino]-N-(furan-2-ylmethyl)benzamide
CID 55466374
6-[3-[2-[2-(2-methoxyanilino)acetyl]hydrazinyl]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55831189
5,7-dimethyl-6-[3-[4-(3-methylbutanoylamino)anilino]-3-oxopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166434882
N-(furan-2-ylmethyl)-2-[3-(4-methoxyphenyl)propanoylamino]benzamide
CID 51188549

Frequently Asked Questions

What is the IUPAC name of 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 55871588) is 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)Nc1ccccc1C(=O)NCc1ccco1.
What is the InChIKey of 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is LAEFEYZMBYZTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O4/c1-14-17(15(2)30-23(28-14)19(13-27-30)22(25)32)9-10-21(31)29-20-8-4-3-7-18(20)24(33)26-12-16-6-5-11-34-16/h3-8,11,13H,9-10,12H2,1-2H3,(H2,25,32)(H,26,33)(H,29,31).
What are the key properties of 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 460.49 g/mol, XLogP of 2.54, 8 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-[2-(furan-2-ylmethylcarbamoyl)anilino]-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 55871588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).