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

C14H17N3O2 — CID 154687718

IUPACN-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide
SMILESCOCCn1cc(-c2cccc(NC(C)=O)c2)cn1
InChIInChI=1S/C14H17N3O2/c1-11(18)16-14-5-3-4-12(8-14)13-9-15-17(10-13)6-7-19-2/h3-5,8-10H,6-7H2,1-2H3,(H,16,18)
InChIKeyBVNJKAFYGFTNOL-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.15
Rot. Bonds5

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

N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide (PubChem CID 154687718) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide
PubChem CID154687718
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide
SMILESCOCCn1cc(-c2cccc(NC(C)=O)c2)cn1
InChIInChI=1S/C14H17N3O2/c1-11(18)16-14-5-3-4-12(8-14)13-9-15-17(10-13)6-7-19-2/h3-5,8-10H,6-7H2,1-2H3,(H,16,18)
InChIKeyBVNJKAFYGFTNOL-UHFFFAOYSA-N
XLogP2.15
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(2-methoxyethyl)pyrazol-4-yl]-3-[3-(1,3-thiazol-2-yl)phenyl]urea
CID 87044600
methyl N-[3-(1-methylpyrazol-4-yl)phenyl]carbamate
CID 110477766
1-(3-methoxypropyl)-4-(3-phenylphenyl)pyrazole
CID 166333734
N-[3-(1-methylpyrazol-4-yl)phenyl]-3-oxobutanamide
CID 110477397
2,6-dihydroxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 103749044
2-[4-[1-(2-methoxyethyl)pyrazol-4-yl]pyrazol-1-yl]ethanol
CID 172649303
N-[3-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]acetamide
CID 154687564
2-bromo-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 54878147
N-[2-[[[1-(2-methoxyethyl)pyrazol-4-yl]amino]methyl]phenyl]acetamide
CID 66418036
N-[3-(1-methylpyrazol-4-yl)phenyl]pyridine-4-carboxamide
CID 110482049
methyl 4-[4-(3-aminophenyl)pyrazol-1-yl]butanoate
CID 63338020
N-methylsulfanyl-3-(1-propylpyrazol-4-yl)aniline
CID 154687703

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide?
The IUPAC name of N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide (CID 154687718) is N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide is COCCn1cc(-c2cccc(NC(C)=O)c2)cn1.
What is the InChIKey of N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide?
The InChIKey is BVNJKAFYGFTNOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-11(18)16-14-5-3-4-12(8-14)13-9-15-17(10-13)6-7-19-2/h3-5,8-10H,6-7H2,1-2H3,(H,16,18).
What are the key properties of N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide?
N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide has a molecular weight of 259.31 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]acetamide is sourced from PubChem (CID 154687718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).