N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide

C20H22N4O3 — CID 95747777

IUPACN,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide
SMILESCc1c(NC(=O)COc2ccc3ccccc3c2)c(C(=O)N(C)C)nn1C
InChIInChI=1S/C20H22N4O3/c1-13-18(19(22-24(13)4)20(26)23(2)3)21-17(25)12-27-16-10-9-14-7-5-6-8-15(14)11-16/h5-11H,12H2,1-4H3,(H,21,25)
InChIKeyZFINEKITUIZGOJ-UHFFFAOYSA-N
MW366.42 g/mol
LogP2.60
Rot. Bonds5

About N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide

N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide (PubChem CID 95747777) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide.

Molecular Properties

Compound NameN,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide
PubChem CID95747777
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC NameN,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide
SMILESCc1c(NC(=O)COc2ccc3ccccc3c2)c(C(=O)N(C)C)nn1C
InChIInChI=1S/C20H22N4O3/c1-13-18(19(22-24(13)4)20(26)23(2)3)21-17(25)12-27-16-10-9-14-7-5-6-8-15(14)11-16/h5-11H,12H2,1-4H3,(H,21,25)
InChIKeyZFINEKITUIZGOJ-UHFFFAOYSA-N
XLogP2.60
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N,1,5-tetramethyl-4-[[2-(2-methylphenoxy)acetyl]amino]pyrazole-3-carboxamide
CID 95747763
N-(1-methylpyrazol-3-yl)-2-naphthalen-2-yloxyacetamide
CID 8810740
2-naphthalen-2-yloxy-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 78838178
methyl 4-[[2-(4-fluorophenoxy)acetyl]amino]-1,5-dimethylpyrazole-3-carboxylate
CID 95748123
4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide
CID 95748088
methyl 4-[[2-(3,5-dimethylphenoxy)acetyl]amino]-1,5-dimethylpyrazole-3-carboxylate
CID 95748126
N-(cyanomethyl)-2-naphthalen-2-yloxyacetamide
CID 51103110
2-(1,3-benzodioxol-5-yloxy)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 9137727
N-[1-[(3,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2-naphthalen-2-yloxyacetamide
CID 19411746
N-naphthalen-2-yl-2-naphthalen-2-yloxyacetamide
CID 879369
N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]-2-naphthalen-2-yloxyacetamide
CID 9247104
N-(2,6-dimethyl-4-oxopyrido[1,2-a]pyrimidin-3-yl)-2-naphthalen-2-yloxyacetamide
CID 18566180

Frequently Asked Questions

What is the IUPAC name of N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide?
The IUPAC name of N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide (CID 95747777) is N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide.
What is the SMILES notation for N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide?
The canonical SMILES for N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide is Cc1c(NC(=O)COc2ccc3ccccc3c2)c(C(=O)N(C)C)nn1C.
What is the InChIKey of N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide?
The InChIKey is ZFINEKITUIZGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-13-18(19(22-24(13)4)20(26)23(2)3)21-17(25)12-27-16-10-9-14-7-5-6-8-15(14)11-16/h5-11H,12H2,1-4H3,(H,21,25).
What are the key properties of N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide?
N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide has a molecular weight of 366.42 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1,5-tetramethyl-4-[(2-naphthalen-2-yloxyacetyl)amino]pyrazole-3-carboxamide is sourced from PubChem (CID 95747777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).