2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide

C18H21N5O2 — CID 166259503

IUPAC2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide
SMILESCOCCn1ccc(NC(=O)Cc2cnn(Cc3ccccc3)c2)n1
InChIInChI=1S/C18H21N5O2/c1-25-10-9-22-8-7-17(21-22)20-18(24)11-16-12-19-23(14-16)13-15-5-3-2-4-6-15/h2-8,12,14H,9-11,13H2,1H3,(H,20,21,24)
InChIKeyBARZCDFAMMXEAY-UHFFFAOYSA-N
MW339.40 g/mol
LogP1.96
Rot. Bonds8

About 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide

2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide (PubChem CID 166259503) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide
PubChem CID166259503
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC Name2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide
SMILESCOCCn1ccc(NC(=O)Cc2cnn(Cc3ccccc3)c2)n1
InChIInChI=1S/C18H21N5O2/c1-25-10-9-22-8-7-17(21-22)20-18(24)11-16-12-19-23(14-16)13-15-5-3-2-4-6-15/h2-8,12,14H,9-11,13H2,1H3,(H,20,21,24)
InChIKeyBARZCDFAMMXEAY-UHFFFAOYSA-N
XLogP1.96
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-benzylpyrazol-3-yl)-2-(1-phenylpyrazol-4-yl)acetamide
CID 47048680
N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide
CID 118519251
3-amino-N-[1-(2-methoxyethyl)pyrazol-3-yl]-3-phenylpropanamide;hydrochloride
CID 119951054
N-[1-(2-methoxyethyl)pyrazol-3-yl]-2-(methylamino)acetamide
CID 119767695
N-(1-benzylpyrazol-3-yl)-2-[4-(6-methoxypyridazin-3-yl)pyrazol-1-yl]acetamide
CID 46995316
1-benzyl-N-(2-methoxyethyl)pyrazole-4-carboxamide
CID 27659405
N-[2-[(1-benzylpyrazol-3-yl)amino]-2-oxoethyl]benzamide
CID 47066196
(3R)-3-[[1-(2-methoxyethyl)pyrazol-4-yl]methylamino]-2,2-dimethyl-3-phenylpropanoic acid
CID 171359065
N-[1-(2-methoxyethyl)pyrazol-3-yl]-1-(pyridin-4-ylmethyl)pyrrole-2-carboxamide
CID 166180657
N-[(1-benzylpyrazol-4-yl)methyl]-2-(4-methylphenyl)acetamide
CID 86990135
N-[1-(2-methoxyethyl)pyrazol-3-yl]-2-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)acetamide
CID 166380020
(2R)-2-[[1-(2-methoxyethyl)pyrazol-4-yl]methylamino]-2-phenylacetic acid
CID 122037992

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide?
The IUPAC name of 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide (CID 166259503) is 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide.
What is the SMILES notation for 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide?
The canonical SMILES for 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide is COCCn1ccc(NC(=O)Cc2cnn(Cc3ccccc3)c2)n1.
What is the InChIKey of 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide?
The InChIKey is BARZCDFAMMXEAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2/c1-25-10-9-22-8-7-17(21-22)20-18(24)11-16-12-19-23(14-16)13-15-5-3-2-4-6-15/h2-8,12,14H,9-11,13H2,1H3,(H,20,21,24).
What are the key properties of 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide?
2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide has a molecular weight of 339.40 g/mol, XLogP of 1.96, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzylpyrazol-4-yl)-N-[1-(2-methoxyethyl)pyrazol-3-yl]acetamide is sourced from PubChem (CID 166259503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).