ethane;N,2,4-trimethylpiperazine-1-carboxamide

C10H23N3O — CID 144801941

IUPACethane;N,2,4-trimethylpiperazine-1-carboxamide
SMILESCC.CNC(=O)N1CCN(C)CC1C
InChIInChI=1S/C8H17N3O.C2H6/c1-7-6-10(3)4-5-11(7)8(12)9-2;1-2/h7H,4-6H2,1-3H3,(H,9,12);1-2H3
InChIKeyARGZKZGAKAREBR-UHFFFAOYSA-N
MW201.31 g/mol
LogP0.99
Rot. Bonds

About ethane;N,2,4-trimethylpiperazine-1-carboxamide

ethane;N,2,4-trimethylpiperazine-1-carboxamide (PubChem CID 144801941) has the molecular formula C10H23N3O and a molecular weight of 201.31 g/mol. Its IUPAC name is ethane;N,2,4-trimethylpiperazine-1-carboxamide.

Molecular Properties

Compound Nameethane;N,2,4-trimethylpiperazine-1-carboxamide
PubChem CID144801941
Molecular FormulaC10H23N3O
Molecular Weight201.31 g/mol
Exact Mass201.18
IUPAC Nameethane;N,2,4-trimethylpiperazine-1-carboxamide
SMILESCC.CNC(=O)N1CCN(C)CC1C
InChIInChI=1S/C8H17N3O.C2H6/c1-7-6-10(3)4-5-11(7)8(12)9-2;1-2/h7H,4-6H2,1-3H3,(H,9,12);1-2H3
InChIKeyARGZKZGAKAREBR-UHFFFAOYSA-N
XLogP0.99
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dimethylpiperazine-1-carboxylic acid;hydrochloride
CID 146446814
1-(2,4-dimethylpiperazin-1-yl)-2,2-dimethylpropan-1-one
CID 23557236
(2,4-dimethylpiperazin-1-yl)-(1-fluorocyclopropyl)methanone;ethane
CID 177202749
(2R)-N-(3-methoxypropyl)-2,4-dimethylpiperazine-1-carboxamide
CID 97093874
3-cyclopropyl-2-[(2,4-dimethylpiperazine-1-carbonyl)amino]propanoic acid
CID 112735135
1-(2,4-dimethylpiperazin-1-yl)-2-(ethylamino)ethanone
CID 103814597
2-amino-1-(2,4-dimethylpiperazin-1-yl)propan-1-one
CID 103814595
2-[(2,4-dimethylpiperazine-1-carbonyl)amino]-4-methylsulfanylbutanoic acid
CID 114086047
2,4-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)piperazine-1-carboxamide
CID 71877060
(2,4-dimethylpiperazin-1-yl)-(1-methoxycyclopropyl)methanone
CID 177202718
1-[4-(2,4-dimethylpiperazine-1-carbonyl)piperidin-1-yl]ethanone
CID 110741134
(2R)-2-amino-1-(2,4-dimethylpiperazin-1-yl)pentan-1-one
CID 103814592

Frequently Asked Questions

What is the IUPAC name of ethane;N,2,4-trimethylpiperazine-1-carboxamide?
The IUPAC name of ethane;N,2,4-trimethylpiperazine-1-carboxamide (CID 144801941) is ethane;N,2,4-trimethylpiperazine-1-carboxamide.
What is the SMILES notation for ethane;N,2,4-trimethylpiperazine-1-carboxamide?
The canonical SMILES for ethane;N,2,4-trimethylpiperazine-1-carboxamide is CC.CNC(=O)N1CCN(C)CC1C.
What is the InChIKey of ethane;N,2,4-trimethylpiperazine-1-carboxamide?
The InChIKey is ARGZKZGAKAREBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O.C2H6/c1-7-6-10(3)4-5-11(7)8(12)9-2;1-2/h7H,4-6H2,1-3H3,(H,9,12);1-2H3.
What are the key properties of ethane;N,2,4-trimethylpiperazine-1-carboxamide?
ethane;N,2,4-trimethylpiperazine-1-carboxamide has a molecular weight of 201.31 g/mol, XLogP of 0.99, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N,2,4-trimethylpiperazine-1-carboxamide is sourced from PubChem (CID 144801941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).