2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide

C11H13N3O2 — CID 112521669

IUPAC2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide
SMILESCc1coc(C)c1C(=O)Nc1cn[nH]c1C
InChIInChI=1S/C11H13N3O2/c1-6-5-16-8(3)10(6)11(15)13-9-4-12-14-7(9)2/h4-5H,1-3H3,(H,12,14)(H,13,15)
InChIKeyXOWXMRNYSWFIND-UHFFFAOYSA-N
MW219.24 g/mol
LogP2.18
Rot. Bonds2

About 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide

2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide (PubChem CID 112521669) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide
PubChem CID112521669
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide
SMILESCc1coc(C)c1C(=O)Nc1cn[nH]c1C
InChIInChI=1S/C11H13N3O2/c1-6-5-16-8(3)10(6)11(15)13-9-4-12-14-7(9)2/h4-5H,1-3H3,(H,12,14)(H,13,15)
InChIKeyXOWXMRNYSWFIND-UHFFFAOYSA-N
XLogP2.18
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-indazol-5-yl)-2,4-dimethylfuran-3-carboxamide
CID 112527200
5-methyl-N-(5-methyl-1H-pyrazol-4-yl)-1H-pyrazole-3-carboxamide
CID 47470885
2-methyl-N-(5-methyl-1H-pyrazol-4-yl)propanamide
CID 130719724
1,1-dimethyl-3-(5-methyl-1H-pyrazol-4-yl)urea
CID 20784611
N-(1H-indol-7-yl)-2,4-dimethylfuran-3-carboxamide
CID 112526566
2-methyl-2-(methylamino)-N-(5-methyl-1H-pyrazol-4-yl)propanamide
CID 83618057
N-(3-hydroxyphenyl)-2,4-dimethylfuran-3-carboxamide
CID 13019986
3-amino-3-methyl-N-(5-methyl-1H-pyrazol-4-yl)butanamide
CID 83618200
N-(5-methyl-1H-pyrazol-4-yl)-1H-indole-5-carboxamide
CID 112521790
1-(5-methyl-1H-pyrazol-4-yl)-3-(5-methyl-2-pyridinyl)urea
CID 166404732
N-(1,2-dimethylbenzimidazol-5-yl)-2,4-dimethylfuran-3-carboxamide
CID 112527535
N-(5-methyl-1H-pyrazol-4-yl)-1,4-dioxaspiro[4.5]decane-8-carboxamide
CID 112521730

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide?
The IUPAC name of 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide (CID 112521669) is 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide is Cc1coc(C)c1C(=O)Nc1cn[nH]c1C.
What is the InChIKey of 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide?
The InChIKey is XOWXMRNYSWFIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-6-5-16-8(3)10(6)11(15)13-9-4-12-14-7(9)2/h4-5H,1-3H3,(H,12,14)(H,13,15).
What are the key properties of 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide?
2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide has a molecular weight of 219.24 g/mol, XLogP of 2.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(5-methyl-1H-pyrazol-4-yl)furan-3-carboxamide is sourced from PubChem (CID 112521669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).