[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone

C15H19N3O2 — CID 105132998

IUPAC[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone
SMILESCCn1ncc(OC)c1C(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C15H19N3O2/c1-5-18-14(13(20-4)10-16-18)15(19)11-6-8-12(9-7-11)17(2)3/h6-10H,5H2,1-4H3
InChIKeyGOGINFRLMKFYDC-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.21
Rot. Bonds5

About [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone

[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone (PubChem CID 105132998) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone.

Molecular Properties

Compound Name[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone
PubChem CID105132998
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone
SMILESCCn1ncc(OC)c1C(=O)c1ccc(N(C)C)cc1
InChIInChI=1S/C15H19N3O2/c1-5-18-14(13(20-4)10-16-18)15(19)11-6-8-12(9-7-11)17(2)3/h6-10H,5H2,1-4H3
InChIKeyGOGINFRLMKFYDC-UHFFFAOYSA-N
XLogP2.21
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(1-ethyl-4-methoxypyrazol-5-yl)-(4-ethylsulfanylphenyl)methanone
CID 106847992
[1-[2-(dimethylamino)ethyl]-4-methoxypyrazol-5-yl]-(4-fluorophenyl)methanone
CID 114638833
(5-bromothiophen-3-yl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 105133000
(1-ethyl-4-methoxypyrazol-5-yl)-(3-methylsulfonylphenyl)methanone
CID 115810193
(4-bromo-1-propylpyrazol-5-yl)-[4-(dimethylamino)phenyl]methanone
CID 105130506
(1-ethyl-4-methoxypyrazol-5-yl)-(3-propoxyphenyl)methanone
CID 115810337
(5-chloro-2-methoxyphenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 115810197
(1-ethyl-4-methoxypyrazol-5-yl)-(2-methylfuran-3-yl)methanone
CID 114642420
2-amino-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methylpropan-1-one
CID 114668718
(1-ethyl-4-methoxypyrazol-5-yl)-(1-methylimidazol-2-yl)methanone
CID 114641940
(1-ethyl-4-methoxypyrazol-5-yl)-(2-fluoro-5-methylphenyl)methanone
CID 115810306
(2-bromo-4-chlorophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanone
CID 107996757

Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone?
The IUPAC name of [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone (CID 105132998) is [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone.
What is the SMILES notation for [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone?
The canonical SMILES for [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone is CCn1ncc(OC)c1C(=O)c1ccc(N(C)C)cc1.
What is the InChIKey of [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone?
The InChIKey is GOGINFRLMKFYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-5-18-14(13(20-4)10-16-18)15(19)11-6-8-12(9-7-11)17(2)3/h6-10H,5H2,1-4H3.
What are the key properties of [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone?
[4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone has a molecular weight of 273.34 g/mol, XLogP of 2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)phenyl]-(1-ethyl-4-methoxypyrazol-5-yl)methanone is sourced from PubChem (CID 105132998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).