[4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone

C15H24N4O — CID 81241066

IUPAC[4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone
SMILESCCNc1ccncc1C(=O)N1CCN(CC)C(C)C1
InChIInChI=1S/C15H24N4O/c1-4-17-14-6-7-16-10-13(14)15(20)19-9-8-18(5-2)12(3)11-19/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,16,17)
InChIKeyMDWAXKGGEPLOFH-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.68
Rot. Bonds4

About [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone

[4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone (PubChem CID 81241066) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name[4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone
PubChem CID81241066
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name[4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone
SMILESCCNc1ccncc1C(=O)N1CCN(CC)C(C)C1
InChIInChI=1S/C15H24N4O/c1-4-17-14-6-7-16-10-13(14)15(20)19-9-8-18(5-2)12(3)11-19/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,16,17)
InChIKeyMDWAXKGGEPLOFH-UHFFFAOYSA-N
XLogP1.68
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-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

(3,5-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
CID 81236821
[4-(ethylamino)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 81236620
[4-(ethylamino)-3-pyridinyl]-(3-ethylpyrrolidin-1-yl)methanone
CID 113418729
(4-ethyl-3-methylpiperazin-1-yl)-(3-fluoro-4-pyridinyl)methanone
CID 115764496
(3-amino-4-pyridinyl)-(4-ethyl-3-methylpiperazin-1-yl)methanone
CID 105070126
[4-(ethylamino)-3-pyridinyl]-piperidin-1-ylmethanone
CID 81236663
[4-(ethylamino)-3-pyridinyl]-(2-methylpyrrolidin-1-yl)methanone
CID 81234090
(2,6-dimethylpiperidin-1-yl)-[4-(ethylamino)-3-pyridinyl]methanone
CID 81236942
(4-ethyl-3-methylpiperazin-1-yl)-[2-(propylamino)phenyl]methanone
CID 63605316
[4-(ethylamino)-2-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone
CID 63604449
(4-methylpiperidin-1-yl)-[4-(propylamino)-3-pyridinyl]methanone
CID 81235903
(4-ethyl-3-methylpiperazin-1-yl)-(2-hydroxyphenyl)methanone
CID 63620718

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone?
The IUPAC name of [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone (CID 81241066) is [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone.
What is the SMILES notation for [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone?
The canonical SMILES for [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone is CCNc1ccncc1C(=O)N1CCN(CC)C(C)C1.
What is the InChIKey of [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone?
The InChIKey is MDWAXKGGEPLOFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-17-14-6-7-16-10-13(14)15(20)19-9-8-18(5-2)12(3)11-19/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,16,17).
What are the key properties of [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone?
[4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone has a molecular weight of 276.38 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)-3-pyridinyl]-(4-ethyl-3-methylpiperazin-1-yl)methanone is sourced from PubChem (CID 81241066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).