[5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone

C20H25N3O — CID 109183327

IUPAC[5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
SMILESCCc1ccccc1Nc1ccc(C(=O)N2CCC(C)CC2)nc1
InChIInChI=1S/C20H25N3O/c1-3-16-6-4-5-7-18(16)22-17-8-9-19(21-14-17)20(24)23-12-10-15(2)11-13-23/h4-9,14-15,22H,3,10-13H2,1-2H3
InChIKeyKNELIVUXPDJEEC-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.26
Rot. Bonds4

About [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone

[5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone (PubChem CID 109183327) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
PubChem CID109183327
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC Name[5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
SMILESCCc1ccccc1Nc1ccc(C(=O)N2CCC(C)CC2)nc1
InChIInChI=1S/C20H25N3O/c1-3-16-6-4-5-7-18(16)22-17-8-9-19(21-14-17)20(24)23-12-10-15(2)11-13-23/h4-9,14-15,22H,3,10-13H2,1-2H3
InChIKeyKNELIVUXPDJEEC-UHFFFAOYSA-N
XLogP4.26
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-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

[5-(2-ethylanilino)-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 109196331
2-[[6-(4-methylpiperidine-1-carbonyl)-3-pyridinyl]amino]benzonitrile
CID 109183409
(4-methylpiperidin-1-yl)-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]methanone
CID 109183358
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[5-(2-ethylanilino)-2-pyridinyl]methanone
CID 109193829
[2-(2-ethylanilino)pyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone
CID 109299223
[5-(2,5-dichloroanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 109183401
1-[3-[[6-(4-methylpiperidine-1-carbonyl)-3-pyridinyl]amino]phenyl]ethanone
CID 109183366
[5-(methylamino)-2-pyridinyl]-(4-methylazepan-1-yl)methanone
CID 113436179
[5-(2-methoxyethylamino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 109183238
[5-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone
CID 109183416
methyl 4-chloro-3-[[6-(4-methylpiperidine-1-carbonyl)-3-pyridinyl]amino]benzoate
CID 109183373
(4-methylpiperidin-1-yl)-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]methanone
CID 109183266

Frequently Asked Questions

What is the IUPAC name of [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone (CID 109183327) is [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone is CCc1ccccc1Nc1ccc(C(=O)N2CCC(C)CC2)nc1.
What is the InChIKey of [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
The InChIKey is KNELIVUXPDJEEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-3-16-6-4-5-7-18(16)22-17-8-9-19(21-14-17)20(24)23-12-10-15(2)11-13-23/h4-9,14-15,22H,3,10-13H2,1-2H3.
What are the key properties of [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone?
[5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone has a molecular weight of 323.44 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-ethylanilino)-2-pyridinyl]-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 109183327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).