ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide

C12H26N2O — CID 145305078

IUPACethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
SMILESCC.CC(=O)NCCC1CCN(C)CC1
InChIInChI=1S/C10H20N2O.C2H6/c1-9(13)11-6-3-10-4-7-12(2)8-5-10;1-2/h10H,3-8H2,1-2H3,(H,11,13);1-2H3
InChIKeyFTUXVGYGVMHIOX-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.88
Rot. Bonds3

About ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide

ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide (PubChem CID 145305078) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide.

Molecular Properties

Compound Nameethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
PubChem CID145305078
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Nameethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
SMILESCC.CC(=O)NCCC1CCN(C)CC1
InChIInChI=1S/C10H20N2O.C2H6/c1-9(13)11-6-3-10-4-7-12(2)8-5-10;1-2/h10H,3-8H2,1-2H3,(H,11,13);1-2H3
InChIKeyFTUXVGYGVMHIOX-UHFFFAOYSA-N
XLogP1.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-acetamido-N-[2-(1-methylpiperidin-4-yl)ethyl]-3-sulfanylpropanamide
CID 107769949
1,1-diethyl-3-[2-(1-methylpiperidin-4-yl)ethyl]urea
CID 113231664
3-(methylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 114515725
4-(aminomethyl)-N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohexane-1-carboxamide
CID 104963837
3-amino-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide
CID 115740928
(2S)-2-amino-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide
CID 103814143
2-(hydroxymethyl)-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide
CID 115186732
2-amino-3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide;dihydrochloride
CID 119865894
3-(tert-butylamino)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 114515771
ethyl 2-[2-(1-methylpiperidin-4-yl)ethylamino]-2-oxoacetate
CID 114516531
1-cyclohexyl-3-[2-(1-methylpiperidin-4-yl)ethyl]urea
CID 115611118
[4-(2-acetamidoethyl)piperidin-1-yl] 2,2,2-trifluoroacetate
CID 68877986

Frequently Asked Questions

What is the IUPAC name of ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
The IUPAC name of ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide (CID 145305078) is ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide.
What is the SMILES notation for ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
The canonical SMILES for ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide is CC.CC(=O)NCCC1CCN(C)CC1.
What is the InChIKey of ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
The InChIKey is FTUXVGYGVMHIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O.C2H6/c1-9(13)11-6-3-10-4-7-12(2)8-5-10;1-2/h10H,3-8H2,1-2H3,(H,11,13);1-2H3.
What are the key properties of ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide?
ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide has a molecular weight of 214.35 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide is sourced from PubChem (CID 145305078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).