ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide

C13H28N4O — CID 143900234

IUPACethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
SMILESCC.CN1CCC(N2CCN(C(N)=O)CC2)CC1
InChIInChI=1S/C11H22N4O.C2H6/c1-13-4-2-10(3-5-13)14-6-8-15(9-7-14)11(12)16;1-2/h10H,2-9H2,1H3,(H2,12,16);1-2H3
InChIKeyVFHYHJHXSOCBHS-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.80
Rot. Bonds1

About ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide

ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide (PubChem CID 143900234) has the molecular formula C13H28N4O and a molecular weight of 256.39 g/mol. Its IUPAC name is ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Nameethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
PubChem CID143900234
Molecular FormulaC13H28N4O
Molecular Weight256.39 g/mol
Exact Mass256.23
IUPAC Nameethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
SMILESCC.CN1CCC(N2CCN(C(N)=O)CC2)CC1
InChIInChI=1S/C11H22N4O.C2H6/c1-13-4-2-10(3-5-13)14-6-8-15(9-7-14)11(12)16;1-2/h10H,2-9H2,1H3,(H2,12,16);1-2H3
InChIKeyVFHYHJHXSOCBHS-UHFFFAOYSA-N
XLogP0.80
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze ethane;4-(1-methylpiperidin-4-yl)piperazine-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

4-cyclopentylpiperazine-1-carboxamide
CID 57205906
4-cyclobutylpiperazine-1-carboxamide
CID 53426578
ethane;1-methyl-4-(1-methylpiperidin-4-yl)piperazine
CID 144911273
(1-methylazetidin-3-yl)-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]methanone
CID 169029279
(1-aminoazetidin-3-yl)-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]methanone
CID 166945971
N-ethyl-4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
CID 70915121
(4-cyclopentylpiperazin-1-yl)-(4-methylpiperazin-1-yl)methanone
CID 121184728
ethane;(1-methylpiperidin-4-yl)-[4-(1-propan-2-ylpiperidin-4-yl)piperazin-1-yl]methanone
CID 176568951
[3-(methylamino)cyclobutyl]-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]methanone
CID 166945999
(2R)-2-amino-2-cyclohexyl-1-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]propan-1-one
CID 91082020
4-(4-methylpiperazin-1-yl)piperidine-1-carbonyl chloride;hydrochloride
CID 168873592
4-[(1-cyclopropylpiperidin-4-yl)amino]piperidine-1-carboxamide
CID 43791337

Frequently Asked Questions

What is the IUPAC name of ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
The IUPAC name of ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide (CID 143900234) is ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide.
What is the SMILES notation for ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
The canonical SMILES for ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide is CC.CN1CCC(N2CCN(C(N)=O)CC2)CC1.
What is the InChIKey of ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
The InChIKey is VFHYHJHXSOCBHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O.C2H6/c1-13-4-2-10(3-5-13)14-6-8-15(9-7-14)11(12)16;1-2/h10H,2-9H2,1H3,(H2,12,16);1-2H3.
What are the key properties of ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide?
ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide has a molecular weight of 256.39 g/mol, XLogP of 0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide is sourced from PubChem (CID 143900234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).