4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide

C14H20N4O2 — CID 78441973

IUPAC4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide
SMILESCN(C)c1ccc(C(=O)N2CCNC(C(N)=O)C2)cc1
InChIInChI=1S/C14H20N4O2/c1-17(2)11-5-3-10(4-6-11)14(20)18-8-7-16-12(9-18)13(15)19/h3-6,12,16H,7-9H2,1-2H3,(H2,15,19)
InChIKeyRYVVUHQWLULIQA-UHFFFAOYSA-N
MW276.34 g/mol
LogP-0.35
Rot. Bonds3

About 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide

4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide (PubChem CID 78441973) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide.

Molecular Properties

Compound Name4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide
PubChem CID78441973
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide
SMILESCN(C)c1ccc(C(=O)N2CCNC(C(N)=O)C2)cc1
InChIInChI=1S/C14H20N4O2/c1-17(2)11-5-3-10(4-6-11)14(20)18-8-7-16-12(9-18)13(15)19/h3-6,12,16H,7-9H2,1-2H3,(H2,15,19)
InChIKeyRYVVUHQWLULIQA-UHFFFAOYSA-N
XLogP-0.35
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(dimethylamino)phenyl]-[(3S)-3-methylpyrrolidin-1-yl]methanone
CID 143704311
[4-(dimethylamino)phenyl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66261919
[(3R)-3-aminopiperidin-1-yl]-[4-(dimethylamino)phenyl]methanone
CID 102983493
(3-chloropiperidin-1-yl)-[4-(dimethylamino)phenyl]methanone
CID 63393268
methyl 4-(4-methoxybenzoyl)piperazine-2-carboxylate
CID 78454952
[4-(dimethylamino)phenyl]-[(3S)-3-(4-methylpiperazin-1-yl)pyrrolidin-1-yl]methanone
CID 99948127
ethyl 4-benzoylpiperazine-2-carboxylate
CID 18412087
[4-(dimethylamino)phenyl]-(3,4,5-trimethylpiperazin-1-yl)methanone
CID 110662268
1-[4-(3-methylpiperazine-1-carbonyl)phenyl]ethanone;hydrochloride
CID 119576231
[3-(bromomethyl)piperidin-1-yl]-[4-(dimethylamino)phenyl]methanone
CID 80660500
4-[4-(dimethylamino)benzoyl]piperazine-2,6-dione
CID 66084706
ethyl 4-[4-(dimethylamino)benzoyl]piperazine-1-carboxylate
CID 35508651

Frequently Asked Questions

What is the IUPAC name of 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide?
The IUPAC name of 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide (CID 78441973) is 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide.
What is the SMILES notation for 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide?
The canonical SMILES for 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide is CN(C)c1ccc(C(=O)N2CCNC(C(N)=O)C2)cc1.
What is the InChIKey of 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide?
The InChIKey is RYVVUHQWLULIQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-17(2)11-5-3-10(4-6-11)14(20)18-8-7-16-12(9-18)13(15)19/h3-6,12,16H,7-9H2,1-2H3,(H2,15,19).
What are the key properties of 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide?
4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of -0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide is sourced from PubChem (CID 78441973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).