4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide

C12H24N4O — CID 58960929

IUPAC4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
SMILESCN1CCC(NC(=O)N2CCN(C)CC2)CC1
InChIInChI=1S/C12H24N4O/c1-14-5-3-11(4-6-14)13-12(17)16-9-7-15(2)8-10-16/h11H,3-10H2,1-2H3,(H,13,17)
InChIKeyPSJYKLZVJRESGT-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.04
Rot. Bonds1

About 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide

4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide (PubChem CID 58960929) has the molecular formula C12H24N4O and a molecular weight of 240.35 g/mol. Its IUPAC name is 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
PubChem CID58960929
Molecular FormulaC12H24N4O
Molecular Weight240.35 g/mol
Exact Mass240.20
IUPAC Name4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
SMILESCN1CCC(NC(=O)N2CCN(C)CC2)CC1
InChIInChI=1S/C12H24N4O/c1-14-5-3-11(4-6-14)13-12(17)16-9-7-15(2)8-10-16/h11H,3-10H2,1-2H3,(H,13,17)
InChIKeyPSJYKLZVJRESGT-UHFFFAOYSA-N
XLogP0.04
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
The IUPAC name of 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide (CID 58960929) is 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide.
What is the SMILES notation for 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
The canonical SMILES for 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide is CN1CCC(NC(=O)N2CCN(C)CC2)CC1.
What is the InChIKey of 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
The InChIKey is PSJYKLZVJRESGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O/c1-14-5-3-11(4-6-14)13-12(17)16-9-7-15(2)8-10-16/h11H,3-10H2,1-2H3,(H,13,17).
What are the key properties of 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide has a molecular weight of 240.35 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(1-methylpiperidin-4-yl)piperazine-1-carboxamide is sourced from PubChem (CID 58960929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).