1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide

C13H26N4O — CID 139907414

IUPAC1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
SMILESCN1CCN(CCN2CCC(C(N)=O)CC2)CC1
InChIInChI=1S/C13H26N4O/c1-15-6-8-17(9-7-15)11-10-16-4-2-12(3-5-16)13(14)18/h12H,2-11H2,1H3,(H2,14,18)
InChIKeyCSFCJLZMMRJQNE-UHFFFAOYSA-N
MW254.38 g/mol
LogP-0.57
Rot. Bonds4

About 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide

1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide (PubChem CID 139907414) has the molecular formula C13H26N4O and a molecular weight of 254.38 g/mol. Its IUPAC name is 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
PubChem CID139907414
Molecular FormulaC13H26N4O
Molecular Weight254.38 g/mol
Exact Mass254.21
IUPAC Name1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
SMILESCN1CCN(CCN2CCC(C(N)=O)CC2)CC1
InChIInChI=1S/C13H26N4O/c1-15-6-8-17(9-7-15)11-10-16-4-2-12(3-5-16)13(14)18/h12H,2-11H2,1H3,(H2,14,18)
InChIKeyCSFCJLZMMRJQNE-UHFFFAOYSA-N
XLogP-0.57
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 5-0.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 18678413
1-octadecylpiperidine-4-carboxamide
CID 4134920
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CID 20792956
1-methylazecane-6-carboxamide
CID 121218409
1-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 168696347
1-(6-methoxyhexyl)piperidine-4-carboxamide
CID 139907421
1-(1-methylazetidin-3-yl)piperidine-4-carboxamide
CID 166069617
benzene;1-ethylpiperidine-4-carboxamide
CID 91582947
1-(methoxymethyl)piperidine-4-carboxamide
CID 78225485
2-(dimethylamino)ethyl 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxylate
CID 118535040
1-[3-[methyl-(1-methylpiperidin-4-yl)sulfamoyl]propyl]piperidine-4-carboxamide
CID 69358248
1,4,7-trimethyl-10-[2-(4,7,10-trimethyl-1,4,7,10-tetrazacyclododec-1-yl)ethyl]-1,4,7,10-tetrazacyclododecane
CID 21130153

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide (CID 139907414) is 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide is CN1CCN(CCN2CCC(C(N)=O)CC2)CC1.
What is the InChIKey of 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide?
The InChIKey is CSFCJLZMMRJQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O/c1-15-6-8-17(9-7-15)11-10-16-4-2-12(3-5-16)13(14)18/h12H,2-11H2,1H3,(H2,14,18).
What are the key properties of 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide?
1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide has a molecular weight of 254.38 g/mol, XLogP of -0.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methylpiperazin-1-yl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 139907414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).