4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide

C9H18N4O2 — CID 60962880

IUPAC4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide
SMILESCN(C)C(=O)N1CCN(C(=O)CN)CC1
InChIInChI=1S/C9H18N4O2/c1-11(2)9(15)13-5-3-12(4-6-13)8(14)7-10/h3-7,10H2,1-2H3
InChIKeyMZPQMMXAIRCELT-UHFFFAOYSA-N
MW214.27 g/mol
LogP-1.23
Rot. Bonds1

About 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide

4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide (PubChem CID 60962880) has the molecular formula C9H18N4O2 and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide
PubChem CID60962880
Molecular FormulaC9H18N4O2
Molecular Weight214.27 g/mol
Exact Mass214.14
IUPAC Name4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide
SMILESCN(C)C(=O)N1CCN(C(=O)CN)CC1
InChIInChI=1S/C9H18N4O2/c1-11(2)9(15)13-5-3-12(4-6-13)8(14)7-10/h3-7,10H2,1-2H3
InChIKeyMZPQMMXAIRCELT-UHFFFAOYSA-N
XLogP-1.23
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 5-1.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide?
The IUPAC name of 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide (CID 60962880) is 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide?
The canonical SMILES for 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide is CN(C)C(=O)N1CCN(C(=O)CN)CC1.
What is the InChIKey of 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide?
The InChIKey is MZPQMMXAIRCELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O2/c1-11(2)9(15)13-5-3-12(4-6-13)8(14)7-10/h3-7,10H2,1-2H3.
What are the key properties of 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide?
4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide has a molecular weight of 214.27 g/mol, XLogP of -1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoacetyl)-N,N-dimethylpiperazine-1-carboxamide is sourced from PubChem (CID 60962880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).