4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide

C14H17N5O2 — CID 65355685

IUPAC4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide
SMILESCN(C)C(=O)c1ccc(NC(=O)c2c(N)cnn2C)cc1
InChIInChI=1S/C14H17N5O2/c1-18(2)14(21)9-4-6-10(7-5-9)17-13(20)12-11(15)8-16-19(12)3/h4-8H,15H2,1-3H3,(H,17,20)
InChIKeyQINHKPOKZZTEMX-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.96
Rot. Bonds3

About 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide

4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide (PubChem CID 65355685) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide
PubChem CID65355685
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC Name4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide
SMILESCN(C)C(=O)c1ccc(NC(=O)c2c(N)cnn2C)cc1
InChIInChI=1S/C14H17N5O2/c1-18(2)14(21)9-4-6-10(7-5-9)17-13(20)12-11(15)8-16-19(12)3/h4-8H,15H2,1-3H3,(H,17,20)
InChIKeyQINHKPOKZZTEMX-UHFFFAOYSA-N
XLogP0.96
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(4-carbamoylphenyl)-1-methylpyrazole-5-carboxamide
CID 65355760
4-amino-N-[4-(methanesulfonamido)phenyl]-1-methylpyrazole-5-carboxamide
CID 65356183
4-amino-N-[3-(dimethylamino)phenyl]-1-methylpyrazole-5-carboxamide
CID 115375767
4-amino-1-methyl-N-pyridin-3-ylpyrazole-5-carboxamide
CID 65355553
4-amino-N-(1,5-dimethylpyrazol-4-yl)-1-methylpyrazole-5-carboxamide
CID 7017546
N-(4-acetamido-3-chlorophenyl)-4-amino-1-methylpyrazole-5-carboxamide
CID 65355536
4-amino-N-(4-chloro-3-methoxyphenyl)-1-methylpyrazole-5-carboxamide
CID 107620644
4-amino-1-methyl-N-(1-propan-2-ylpyrazol-4-yl)pyrazole-5-carboxamide
CID 65360004
N-(4-acetylphenyl)-4-amino-1-ethylpyrazole-5-carboxamide
CID 65357059
4-amino-N-[3-(methoxymethyl)phenyl]-1-methylpyrazole-5-carboxamide
CID 65359651
ethyl 4-[(4-chloro-1-methylpyrazole-5-carbonyl)amino]benzoate
CID 973643
4-amino-1-methyl-N-(4-methyl-2-pyridinyl)pyrazole-5-carboxamide
CID 65355663

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide (CID 65355685) is 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide is CN(C)C(=O)c1ccc(NC(=O)c2c(N)cnn2C)cc1.
What is the InChIKey of 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide?
The InChIKey is QINHKPOKZZTEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-18(2)14(21)9-4-6-10(7-5-9)17-13(20)12-11(15)8-16-19(12)3/h4-8H,15H2,1-3H3,(H,17,20).
What are the key properties of 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide?
4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(dimethylcarbamoyl)phenyl]-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 65355685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).