N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide

C75H80F2N20O7S — CID 159183600

IUPACN-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide
SMILESCCc1ccnc(-n2nc(C)cc2NC(=O)c2ccccc2F)n1.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2)[nH]c(=O)c1CC.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2F)[nH]c(=O)c1CC.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2SC)[nH]c(=O)c1CC
InChIInChI=1S/C20H23N5O2S.C19H20FN5O2.C19H21N5O2.C17H16FN5O/c1-5-13-15(6-2)21-20(23-18(13)26)25-17(11-12(3)24-25)22-19(27)14-9-7-8-10-16(14)28-4;1-4-12-15(5-2)21-19(23-17(12)26)25-16(10-11(3)24-25)22-18(27)13-8-6-7-9-14(13)20;1-4-14-15(5-2)20-19(22-18(14)26)24-16(11-12(3)23-24)21-17(25)13-9-7-6-8-10-13;1-3-12-8-9-19-17(20-12)23-15(10-11(2)22-23)21-16(24)13-6-4-5-7-14(13)18/h7-11H,5-6H2,1-4H3,(H,22,27)(H,21,23,26);6-10H,4-5H2,1-3H3,(H,22,27)(H,21,23,26);6-11H,4-5H2,1-3H3,(H,21,25)(H,20,22,26);4-10H,3H2,1-2H3,(H,21,24)
InChIKeyKNEZPBTXVGOARO-UHFFFAOYSA-N
MW1443.66 g/mol
LogP11.71
Rot. Bonds20

About N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide

N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide (PubChem CID 159183600) has the molecular formula C75H80F2N20O7S and a molecular weight of 1443.66 g/mol. Its IUPAC name is N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide
PubChem CID159183600
Molecular FormulaC75H80F2N20O7S
Molecular Weight1443.66 g/mol
Exact Mass1442.62
IUPAC NameN-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide
SMILESCCc1ccnc(-n2nc(C)cc2NC(=O)c2ccccc2F)n1.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2)[nH]c(=O)c1CC.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2F)[nH]c(=O)c1CC.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2SC)[nH]c(=O)c1CC
InChIInChI=1S/C20H23N5O2S.C19H20FN5O2.C19H21N5O2.C17H16FN5O/c1-5-13-15(6-2)21-20(23-18(13)26)25-17(11-12(3)24-25)22-19(27)14-9-7-8-10-16(14)28-4;1-4-12-15(5-2)21-19(23-17(12)26)25-16(10-11(3)24-25)22-18(27)13-8-6-7-9-14(13)20;1-4-14-15(5-2)20-19(22-18(14)26)24-16(11-12(3)23-24)21-17(25)13-9-7-6-8-10-13;1-3-12-8-9-19-17(20-12)23-15(10-11(2)22-23)21-16(24)13-6-4-5-7-14(13)18/h7-11H,5-6H2,1-4H3,(H,22,27)(H,21,23,26);6-10H,4-5H2,1-3H3,(H,22,27)(H,21,23,26);6-11H,4-5H2,1-3H3,(H,21,25)(H,20,22,26);4-10H,3H2,1-2H3,(H,21,24)
InChIKeyKNEZPBTXVGOARO-UHFFFAOYSA-N
XLogP11.71
TPSA350.71 Ų
H-Bond Donors7
H-Bond Acceptors21
Rotatable Bonds20
Heavy Atoms105
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001443.66
LogP ≤ 511.71
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1021

Analyze N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide with MolForge

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Related Compounds

N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide
CID 137436400
N-[5-methyl-2-(4-oxo-5,6,7,8-tetrahydro-3H-quinazolin-2-yl)pyrazol-3-yl]-2-methylsulfanylbenzamide
CID 137436427
N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-2-methylsulfanylbenzamide
CID 135752996
2-fluoro-N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]benzamide
CID 135752929
4-chloro-N-[5-methyl-2-(6-oxo-4-propan-2-yl-1H-pyrimidin-2-yl)pyrazol-3-yl]benzamide;N-[2-(4-cyclopropyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4-cyclopropyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4-cyclopropyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methoxybenzamide;N-[2-(4-cyclopropyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide
CID 158801125
N-[2-(5-ethyl-4-methyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2,5-dimethylfuran-3-carboxamide
CID 136636542
N-[2-(5-ethyl-4-methyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-3-methoxy-1-methylpyrazole-4-carboxamide
CID 136636820
N-[2-(4-chlorophenyl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide
CID 112810243
2-chloro-N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-6-fluorobenzamide
CID 135753087
N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-4-(hydroxymethyl)benzamide
CID 156672559
N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-3-methoxybenzamide
CID 135753062
N-[2-(5-ethyl-4-methyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]propanamide
CID 135551621

Frequently Asked Questions

What is the IUPAC name of N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide?
The IUPAC name of N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide (CID 159183600) is N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide.
What is the SMILES notation for N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide?
The canonical SMILES for N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide is CCc1ccnc(-n2nc(C)cc2NC(=O)c2ccccc2F)n1.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2)[nH]c(=O)c1CC.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2F)[nH]c(=O)c1CC.CCc1nc(-n2nc(C)cc2NC(=O)c2ccccc2SC)[nH]c(=O)c1CC.
What is the InChIKey of N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide?
The InChIKey is KNEZPBTXVGOARO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2S.C19H20FN5O2.C19H21N5O2.C17H16FN5O/c1-5-13-15(6-2)21-20(23-18(13)26)25-17(11-12(3)24-25)22-19(27)14-9-7-8-10-16(14)28-4;1-4-12-15(5-2)21-19(23-17(12)26)25-16(10-11(3)24-25)22-18(27)13-8-6-7-9-14(13)20;1-4-14-15(5-2)20-19(22-18(14)26)24-16(11-12(3)23-24)21-17(25)13-9-7-6-8-10-13;1-3-12-8-9-19-17(20-12)23-15(10-11(2)22-23)21-16(24)13-6-4-5-7-14(13)18/h7-11H,5-6H2,1-4H3,(H,22,27)(H,21,23,26);6-10H,4-5H2,1-3H3,(H,22,27)(H,21,23,26);6-11H,4-5H2,1-3H3,(H,21,25)(H,20,22,26);4-10H,3H2,1-2H3,(H,21,24).
What are the key properties of N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide?
N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide has a molecular weight of 1443.66 g/mol, XLogP of 11.71, 20 rotatable bonds, 7 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]benzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide;N-[2-(4,5-diethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-methylsulfanylbenzamide;N-[2-(4-ethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-fluorobenzamide is sourced from PubChem (CID 159183600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).