N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide

C18H15N3O2 — CID 17462774

IUPACN-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2ccc3oc4ccccc4c3c2)cnn1C
InChIInChI=1S/C18H15N3O2/c1-11-15(10-19-21(11)2)18(22)20-12-7-8-17-14(9-12)13-5-3-4-6-16(13)23-17/h3-10H,1-2H3,(H,20,22)
InChIKeyHDCBCDCLKFJMLP-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.88
Rot. Bonds2

About N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide

N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide (PubChem CID 17462774) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide
PubChem CID17462774
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC NameN-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2ccc3oc4ccccc4c3c2)cnn1C
InChIInChI=1S/C18H15N3O2/c1-11-15(10-19-21(11)2)18(22)20-12-7-8-17-14(9-12)13-5-3-4-6-16(13)23-17/h3-10H,1-2H3,(H,20,22)
InChIKeyHDCBCDCLKFJMLP-UHFFFAOYSA-N
XLogP3.88
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,5-dimethyl-N-phenylpyrazole-4-carboxamide
CID 13031735
N-dibenzofuran-2-yl-5-methyl-1,2-oxazole-3-carboxamide
CID 17430004
N-(3-aminophenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 28776770
N-(3-chloro-4-hydroxyphenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 63935503
2-chloro-4-[(1,5-dimethylpyrazole-4-carbonyl)amino]benzoic acid
CID 61398585
N-(3-amino-4-fluorophenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 28776839
N-dibenzofuran-2-yl-2-ethoxybenzamide
CID 16552367
N-(3,4-dimethylphenyl)dibenzofuran-2-carboxamide
CID 18876126
N-(4-amino-3-methoxyphenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 61241001
4-[(1,5-dimethylpyrazole-4-carbonyl)amino]benzenesulfonyl chloride
CID 43095846
4-[(1,5-dimethylpyrazole-4-carbonyl)amino]pyridine-2-carboxylic acid
CID 55246685
(2R)-2-amino-N-dibenzofuran-2-ylpropanamide
CID 54996249

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide (CID 17462774) is N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide is Cc1c(C(=O)Nc2ccc3oc4ccccc4c3c2)cnn1C.
What is the InChIKey of N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide?
The InChIKey is HDCBCDCLKFJMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c1-11-15(10-19-21(11)2)18(22)20-12-7-8-17-14(9-12)13-5-3-4-6-16(13)23-17/h3-10H,1-2H3,(H,20,22).
What are the key properties of N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide?
N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide has a molecular weight of 305.34 g/mol, XLogP of 3.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-1,5-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 17462774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).