N,N-diethyl-4-methylpiperazine-1-carboxamide

C10H21N3O — CID 3052

💊View drug profile → diethylcarbamazine
IUPACN,N-diethyl-4-methylpiperazine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCN(C)CC1
InChIInChI=1S/C10H21N3O/c1-4-12(5-2)10(14)13-8-6-11(3)7-9-13/h4-9H2,1-3H3
InChIKeyRCKMWOKWVGPNJF-UHFFFAOYSA-N
MW199.30 g/mol
LogP0.70
Rot. Bonds2

About N,N-diethyl-4-methylpiperazine-1-carboxamide

N,N-diethyl-4-methylpiperazine-1-carboxamide (PubChem CID 3052) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N,N-diethyl-4-methylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-methylpiperazine-1-carboxamide
PubChem CID3052
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN,N-diethyl-4-methylpiperazine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCN(C)CC1
InChIInChI=1S/C10H21N3O/c1-4-12(5-2)10(14)13-8-6-11(3)7-9-13/h4-9H2,1-3H3
InChIKeyRCKMWOKWVGPNJF-UHFFFAOYSA-N
XLogP0.70
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-4-methylpiperazine-1-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

Tetraethylurea
CID 14465
Diethylcarbamazine Monohydrochloride
CID 79300
N,N'-Diethylpropyleneurea
CID 99136
N,N'-Dipropylpropyleneurea
CID 99137
N,N,N',N',2-pentamethyl-1,4-piperazinedicarboxamide
CID 3151560
1-N,4-N-dimethylpiperazine-1,4-dicarboxamide
CID 349503
n-Ethyl-4-methylpiperazine-1-carboxamide
CID 116045
1-Diethylcarbamyl-4-ethylpiperazine
CID 127066
1-Piperazinecarboxamide, N,N,4-trimethyl-, hydrochloride
CID 116048
N,N-Diethylpiperazine-1-carboxamide
CID 67067
4-Methylpiperazine-1-carboxamide
CID 410261
1-N,1-N,4-N,4-N-tetramethylpiperazine-1,4-dicarboxamide
CID 654698

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-methylpiperazine-1-carboxamide?
The IUPAC name of N,N-diethyl-4-methylpiperazine-1-carboxamide (CID 3052) is N,N-diethyl-4-methylpiperazine-1-carboxamide.
What is the SMILES notation for N,N-diethyl-4-methylpiperazine-1-carboxamide?
The canonical SMILES for N,N-diethyl-4-methylpiperazine-1-carboxamide is CCN(CC)C(=O)N1CCN(C)CC1.
What is the InChIKey of N,N-diethyl-4-methylpiperazine-1-carboxamide?
The InChIKey is RCKMWOKWVGPNJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-4-12(5-2)10(14)13-8-6-11(3)7-9-13/h4-9H2,1-3H3.
What are the key properties of N,N-diethyl-4-methylpiperazine-1-carboxamide?
N,N-diethyl-4-methylpiperazine-1-carboxamide has a molecular weight of 199.30 g/mol, XLogP of 0.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-methylpiperazine-1-carboxamide is sourced from PubChem (CID 3052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).