1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone

C17H26N4O — CID 95824950

IUPAC1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(c2cnc(N3CCC(C)CC3)cn2)CC1
InChIInChI=1S/C17H26N4O/c1-13-3-7-21(8-4-13)17-12-18-16(11-19-17)15-5-9-20(10-6-15)14(2)22/h11-13,15H,3-10H2,1-2H3
InChIKeyGOCYCOSDVVJFQF-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.44
Rot. Bonds2

About 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone

1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone (PubChem CID 95824950) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
PubChem CID95824950
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(c2cnc(N3CCC(C)CC3)cn2)CC1
InChIInChI=1S/C17H26N4O/c1-13-3-7-21(8-4-13)17-12-18-16(11-19-17)15-5-9-20(10-6-15)14(2)22/h11-13,15H,3-10H2,1-2H3
InChIKeyGOCYCOSDVVJFQF-UHFFFAOYSA-N
XLogP2.44
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone 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

1-[4-[2-(4-methylpiperidin-1-yl)-4-pyridinyl]piperidin-1-yl]ethanone
CID 95824947
ethane;2-methyl-5-(4-methylpiperidin-1-yl)pyrazine
CID 144954602
3-[5-(1-acetylpiperidin-4-yl)pyrazin-2-yl]-1-oxa-3-azaspiro[4.5]decan-2-one
CID 110099000
1-[(3S)-3-[6-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95824949
1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 110102442
(4-ethylpiperazin-1-yl)-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]methanone
CID 109275194
N-cycloheptyl-5-(4-methylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109275249
(4-methylpiperidin-1-yl)-[5-(4-pyridin-2-ylpiperazin-1-yl)pyrazin-2-yl]methanone
CID 109275060
(4-aminopiperidin-1-yl)-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methanone
CID 119374279
(4-methylpiperidin-1-yl)-[5-(3-methylpiperidin-1-yl)pyrazin-2-yl]methanone
CID 109275074
1-[4-(5-pyrimidin-5-yl-2-pyridinyl)piperidin-1-yl]ethanone
CID 95834066
(5R)-3-[5-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]pyrazin-2-yl]-5-methyl-1,3-oxazolidin-2-one
CID 124995225

Frequently Asked Questions

What is the IUPAC name of 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone (CID 95824950) is 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone is CC(=O)N1CCC(c2cnc(N3CCC(C)CC3)cn2)CC1.
What is the InChIKey of 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
The InChIKey is GOCYCOSDVVJFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-13-3-7-21(8-4-13)17-12-18-16(11-19-17)15-5-9-20(10-6-15)14(2)22/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone has a molecular weight of 302.42 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone is sourced from PubChem (CID 95824950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).