4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide

C15H20N4O2 — CID 102903117

IUPAC4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide
SMILESCOCCc1ccccc1NC(=O)c1c(N)c(C)nn1C
InChIInChI=1S/C15H20N4O2/c1-10-13(16)14(19(2)18-10)15(20)17-12-7-5-4-6-11(12)8-9-21-3/h4-7H,8-9,16H2,1-3H3,(H,17,20)
InChIKeyRUDUUPIWWQASSQ-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.75
Rot. Bonds5

About 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide

4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide (PubChem CID 102903117) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide
PubChem CID102903117
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide
SMILESCOCCc1ccccc1NC(=O)c1c(N)c(C)nn1C
InChIInChI=1S/C15H20N4O2/c1-10-13(16)14(19(2)18-10)15(20)17-12-7-5-4-6-11(12)8-9-21-3/h4-7H,8-9,16H2,1-3H3,(H,17,20)
InChIKeyRUDUUPIWWQASSQ-UHFFFAOYSA-N
XLogP1.75
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(2-chlorophenyl)-1,3-dimethylpyrazole-5-carboxamide
CID 66119861
4-amino-3-ethyl-N-[2-(methoxymethyl)phenyl]-1-methylpyrazole-5-carboxamide
CID 66117385
2-amino-N-[2-(2-methoxyethyl)phenyl]-3-methylbenzamide
CID 102903119
5-amino-N-[2-(2-methoxyethyl)phenyl]pyrazine-2-carboxamide
CID 107377211
4-amino-N-(4-methoxy-2-methylphenyl)-1,3-dimethylpyrazole-5-carboxamide
CID 66124203
4-amino-N-[(2-ethylphenyl)methyl]-1,3-dimethylpyrazole-5-carboxamide
CID 66125184
4-amino-1,3-dimethyl-N-pyrimidin-2-ylpyrazole-5-carboxamide
CID 66121641
4-amino-N-(5-chloro-2-methoxyphenyl)-1,3-dimethylpyrazole-5-carboxamide
CID 66121449
N-[2-(2-methoxyethyl)phenyl]-1-phenyl-1,2,4-triazole-3-carboxamide
CID 166217474
2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide
CID 102907951
4-amino-N-[(2-bromophenyl)methyl]-1,3-dimethylpyrazole-5-carboxamide
CID 66123415
1-ethyl-5-N-[2-(2-methoxyethyl)phenyl]-3-methylpyrazole-4,5-diamine
CID 102903455

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide (CID 102903117) is 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide is COCCc1ccccc1NC(=O)c1c(N)c(C)nn1C.
What is the InChIKey of 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide?
The InChIKey is RUDUUPIWWQASSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10-13(16)14(19(2)18-10)15(20)17-12-7-5-4-6-11(12)8-9-21-3/h4-7H,8-9,16H2,1-3H3,(H,17,20).
What are the key properties of 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide?
4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(2-methoxyethyl)phenyl]-1,3-dimethylpyrazole-5-carboxamide is sourced from PubChem (CID 102903117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).