N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide

C17H19N5O2 — CID 19340083

IUPACN-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide
SMILESCCn1cc(Cn2cc(NC(=O)c3ccc(OC)cc3)cn2)cn1
InChIInChI=1S/C17H19N5O2/c1-3-21-10-13(8-18-21)11-22-12-15(9-19-22)20-17(23)14-4-6-16(24-2)7-5-14/h4-10,12H,3,11H2,1-2H3,(H,20,23)
InChIKeyRHXGWXARBZYMRQ-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.41
Rot. Bonds6

About N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide

N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide (PubChem CID 19340083) has the molecular formula C17H19N5O2 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide
PubChem CID19340083
Molecular FormulaC17H19N5O2
Molecular Weight325.37 g/mol
Exact Mass325.15
IUPAC NameN-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide
SMILESCCn1cc(Cn2cc(NC(=O)c3ccc(OC)cc3)cn2)cn1
InChIInChI=1S/C17H19N5O2/c1-3-21-10-13(8-18-21)11-22-12-15(9-19-22)20-17(23)14-4-6-16(24-2)7-5-14/h4-10,12H,3,11H2,1-2H3,(H,20,23)
InChIKeyRHXGWXARBZYMRQ-UHFFFAOYSA-N
XLogP2.41
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-1-[(4-methoxyphenoxy)methyl]pyrazole-3-carboxamide
CID 19273300
4-[(2,6-dimethylphenoxy)methyl]-N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]benzamide
CID 19340160
N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-4-[(4-methoxyphenoxy)methyl]benzamide
CID 19338461
4-amino-N-(1-ethylpyrazol-4-yl)benzamide
CID 43543193
4-[(2,4-dichlorophenoxy)methyl]-N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]benzamide
CID 19340094
4-ethoxy-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide
CID 19400060
N-(1-benzylpyrazol-4-yl)-1-ethylpyrazole-4-carboxamide
CID 19395795
2-chloro-N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]benzamide
CID 19340031
2-ethoxy-N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]benzamide
CID 19340226
N-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-4-yl]-4-methoxybenzamide
CID 19410382
N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]-3,5-dimethoxybenzamide
CID 19403933
N-[1-[2-(cyclopentylamino)-2-oxoethyl]pyrazol-4-yl]-4-methoxybenzamide
CID 49055659

Frequently Asked Questions

What is the IUPAC name of N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide?
The IUPAC name of N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide (CID 19340083) is N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide.
What is the SMILES notation for N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide?
The canonical SMILES for N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide is CCn1cc(Cn2cc(NC(=O)c3ccc(OC)cc3)cn2)cn1.
What is the InChIKey of N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide?
The InChIKey is RHXGWXARBZYMRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2/c1-3-21-10-13(8-18-21)11-22-12-15(9-19-22)20-17(23)14-4-6-16(24-2)7-5-14/h4-10,12H,3,11H2,1-2H3,(H,20,23).
What are the key properties of N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide?
N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide has a molecular weight of 325.37 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]-4-methoxybenzamide is sourced from PubChem (CID 19340083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).