4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide

C13H24N4O2 — CID 2056604

IUPAC4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide
SMILESNC(=O)CN1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C13H24N4O2/c14-12(18)10-16-6-8-17(9-7-16)13(19)15-11-4-2-1-3-5-11/h11H,1-10H2,(H2,14,18)(H,15,19)
InChIKeyUNZBIXIRXYCTSE-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.13
Rot. Bonds3

About 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide

4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide (PubChem CID 2056604) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide
PubChem CID2056604
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC Name4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide
SMILESNC(=O)CN1CCN(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C13H24N4O2/c14-12(18)10-16-6-8-17(9-7-16)13(19)15-11-4-2-1-3-5-11/h11H,1-10H2,(H2,14,18)(H,15,19)
InChIKeyUNZBIXIRXYCTSE-UHFFFAOYSA-N
XLogP0.13
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide?
The IUPAC name of 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide (CID 2056604) is 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide?
The canonical SMILES for 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide is NC(=O)CN1CCN(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide?
The InChIKey is UNZBIXIRXYCTSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c14-12(18)10-16-6-8-17(9-7-16)13(19)15-11-4-2-1-3-5-11/h11H,1-10H2,(H2,14,18)(H,15,19).
What are the key properties of 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide?
4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide has a molecular weight of 268.36 g/mol, XLogP of 0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-oxoethyl)-N-cyclohexylpiperazine-1-carboxamide is sourced from PubChem (CID 2056604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).