[4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone

C24H28N4O2 — CID 110243415

IUPAC[4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone
SMILESCCOCc1ccc(C(=O)N2CCCC2c2nn(C)cc2-c2ccncc2C)cc1
InChIInChI=1S/C24H28N4O2/c1-4-30-16-18-7-9-19(10-8-18)24(29)28-13-5-6-22(28)23-21(15-27(3)26-23)20-11-12-25-14-17(20)2/h7-12,14-15,22H,4-6,13,16H2,1-3H3
InChIKeyUGTQBIZYLWNJCO-UHFFFAOYSA-N
MW404.51 g/mol
LogP4.30
Rot. Bonds6

About [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone

[4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone (PubChem CID 110243415) has the molecular formula C24H28N4O2 and a molecular weight of 404.51 g/mol. Its IUPAC name is [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name[4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone
PubChem CID110243415
Molecular FormulaC24H28N4O2
Molecular Weight404.51 g/mol
Exact Mass404.22
IUPAC Name[4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone
SMILESCCOCc1ccc(C(=O)N2CCCC2c2nn(C)cc2-c2ccncc2C)cc1
InChIInChI=1S/C24H28N4O2/c1-4-30-16-18-7-9-19(10-8-18)24(29)28-13-5-6-22(28)23-21(15-27(3)26-23)20-11-12-25-14-17(20)2/h7-12,14-15,22H,4-6,13,16H2,1-3H3
InChIKeyUGTQBIZYLWNJCO-UHFFFAOYSA-N
XLogP4.30
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(2-methoxyethoxy)phenyl]-[(2R)-2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone
CID 92563520
[(2S)-2-[2-(dimethylamino)-5-pyridin-4-ylpyrimidin-4-yl]piperidin-1-yl]-[4-(ethoxymethyl)phenyl]methanone
CID 92593179
[(2S)-2-[1-methyl-4-(3-methyl-1,2-oxazol-5-yl)pyrazol-3-yl]piperidin-1-yl]-pyridin-4-ylmethanone
CID 92554308
[(2R)-2-[1-methyl-4-(3-methyl-1,2-oxazol-5-yl)pyrazol-3-yl]piperidin-1-yl]-pyridin-4-ylmethanone
CID 92554309
[4-(methoxymethyl)phenyl]-[(2R)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone
CID 95322352
(4-ethylphenyl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 42939220
[4-(ethoxymethyl)phenyl]-[(2R)-2-(7-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidin-1-yl]methanone
CID 95833928
2-(4-ethoxyphenyl)-1-[(2S)-2-(1-methyl-4-pyridin-4-ylpyrazol-3-yl)piperidin-1-yl]ethanone
CID 92593691
3-(4-ethoxyphenyl)-1-[2-[2-methyl-5-(3-methyl-4-pyridinyl)pyrimidin-4-yl]piperidin-1-yl]propan-1-one
CID 110218288
1-[2-[2-methyl-5-(3-methyl-4-pyridinyl)pyrimidin-4-yl]pyrrolidin-1-yl]-2-(4-methylphenyl)ethanone
CID 110218145
(2-ethoxy-3-pyridinyl)-[(2S)-2-[2-methyl-5-(3-methyl-4-pyridinyl)pyrimidin-4-yl]piperidin-1-yl]methanone
CID 92593239
[(2S)-2-[2-(dimethylamino)-5-(3-methyl-4-pyridinyl)pyrimidin-4-yl]piperidin-1-yl]-(6-methoxy-3-pyridinyl)methanone
CID 92563591

Frequently Asked Questions

What is the IUPAC name of [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone?
The IUPAC name of [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone (CID 110243415) is [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone.
What is the SMILES notation for [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone?
The canonical SMILES for [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone is CCOCc1ccc(C(=O)N2CCCC2c2nn(C)cc2-c2ccncc2C)cc1.
What is the InChIKey of [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone?
The InChIKey is UGTQBIZYLWNJCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O2/c1-4-30-16-18-7-9-19(10-8-18)24(29)28-13-5-6-22(28)23-21(15-27(3)26-23)20-11-12-25-14-17(20)2/h7-12,14-15,22H,4-6,13,16H2,1-3H3.
What are the key properties of [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone?
[4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone has a molecular weight of 404.51 g/mol, XLogP of 4.30, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethoxymethyl)phenyl]-[2-[1-methyl-4-(3-methyl-4-pyridinyl)pyrazol-3-yl]pyrrolidin-1-yl]methanone is sourced from PubChem (CID 110243415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).