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

C10H19N3O3 — CID 60757389

IUPAC4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide
SMILESCOCC(=O)N1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C10H19N3O3/c1-11(2)10(15)13-6-4-12(5-7-13)9(14)8-16-3/h4-8H2,1-3H3
InChIKeyTUPZXZFILQHSLG-UHFFFAOYSA-N
MW229.28 g/mol
LogP-0.54
Rot. Bonds2

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

4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide (PubChem CID 60757389) has the molecular formula C10H19N3O3 and a molecular weight of 229.28 g/mol. Its IUPAC name is 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide
PubChem CID60757389
Molecular FormulaC10H19N3O3
Molecular Weight229.28 g/mol
Exact Mass229.14
IUPAC Name4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide
SMILESCOCC(=O)N1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C10H19N3O3/c1-11(2)10(15)13-6-4-12(5-7-13)9(14)8-16-3/h4-8H2,1-3H3
InChIKeyTUPZXZFILQHSLG-UHFFFAOYSA-N
XLogP-0.54
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(2-methoxyethoxy)acetyl]-N,N-dimethylpiperazine-1-carboxamide
CID 108570063
2-(dimethylamino)-1-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]ethanone
CID 56751090
1-[4-(2-methoxyacetyl)piperazin-1-yl]-2-(propan-2-ylamino)ethanone
CID 54872189
1-[4-(2-methoxyacetyl)piperazin-1-yl]butane-1,3-dione
CID 54876612
3-[4-(dimethylcarbamoyl)piperazin-1-yl]-3-oxopropanoic acid
CID 62231766
1-(4-acetyl-1,4-diazepan-1-yl)-2-methoxyethanone
CID 60712313
1-[4-(2-methoxyacetyl)piperazin-1-yl]-2-(methylamino)ethanone
CID 60947029
1-[4-[(2R)-2-hydroxypropyl]piperazin-1-yl]-2-methoxyethanone
CID 95606801
1-[4-(2-hydroxypropyl)piperazin-1-yl]-2-methoxyethanone
CID 56802428
1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-methoxyethanone
CID 60637500
2-amino-1-[4-(2-methoxyacetyl)piperazin-1-yl]-3-methylbutan-1-one
CID 54872163
(3aS,6aR)-1'-(2-methoxyacetyl)-N,N-dimethyl-1-oxospiro[3a,4,6,6a-tetrahydro-2H-pyrrolo[3,4-c]pyrrole-3,4'-piperidine]-5-carboxamide
CID 97439101

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide?
The IUPAC name of 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide (CID 60757389) is 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide?
The canonical SMILES for 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide is COCC(=O)N1CCN(C(=O)N(C)C)CC1.
What is the InChIKey of 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide?
The InChIKey is TUPZXZFILQHSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O3/c1-11(2)10(15)13-6-4-12(5-7-13)9(14)8-16-3/h4-8H2,1-3H3.
What are the key properties of 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide?
4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide has a molecular weight of 229.28 g/mol, XLogP of -0.54, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyacetyl)-N,N-dimethylpiperazine-1-carboxamide is sourced from PubChem (CID 60757389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).