5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide

C19H26N4O3 — CID 110336758

IUPAC5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
SMILESCOc1ccc(C)cc1-c1cc(C(=O)NCCN2CCOCC2)nn1C
InChIInChI=1S/C19H26N4O3/c1-14-4-5-18(25-3)15(12-14)17-13-16(21-22(17)2)19(24)20-6-7-23-8-10-26-11-9-23/h4-5,12-13H,6-11H2,1-3H3,(H,20,24)
InChIKeyKHGGLLLBPAYYQV-UHFFFAOYSA-N
MW358.44 g/mol
LogP1.47
Rot. Bonds6

About 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide

5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide (PubChem CID 110336758) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
PubChem CID110336758
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
SMILESCOc1ccc(C)cc1-c1cc(C(=O)NCCN2CCOCC2)nn1C
InChIInChI=1S/C19H26N4O3/c1-14-4-5-18(25-3)15(12-14)17-13-16(21-22(17)2)19(24)20-6-7-23-8-10-26-11-9-23/h4-5,12-13H,6-11H2,1-3H3,(H,20,24)
InChIKeyKHGGLLLBPAYYQV-UHFFFAOYSA-N
XLogP1.47
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-methylpropyl)pyrazole-3-carboxamide
CID 110336747
1-methyl-5-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pyrazole-3-carboxamide
CID 110305501
5-(2-methoxy-5-methylphenyl)-1-methyl-N-prop-2-enylpyrazole-3-carboxamide
CID 110336745
1-methyl-5-[2-(4-methylphenyl)ethynyl]-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 46847550
2,5-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 51072890
3-(2-methoxy-5-methylanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016626
2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
CID 110761441
2-methoxy-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 131898398
5-(2-methoxy-5-methylphenyl)-N-(3-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 110336789
1-(methoxymethyl)-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 19270984
1-methyl-5-(3-methyl-1-methylsulfonylindol-5-yl)-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide
CID 66988766
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The IUPAC name of 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide (CID 110336758) is 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide.
What is the SMILES notation for 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The canonical SMILES for 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide is COc1ccc(C)cc1-c1cc(C(=O)NCCN2CCOCC2)nn1C.
What is the InChIKey of 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
The InChIKey is KHGGLLLBPAYYQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c1-14-4-5-18(25-3)15(12-14)17-13-16(21-22(17)2)19(24)20-6-7-23-8-10-26-11-9-23/h4-5,12-13H,6-11H2,1-3H3,(H,20,24).
What are the key properties of 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide?
5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide has a molecular weight of 358.44 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-5-methylphenyl)-1-methyl-N-(2-morpholin-4-ylethyl)pyrazole-3-carboxamide is sourced from PubChem (CID 110336758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).