ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide

C12H28N2O2 — CID 177000200

IUPACethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide
SMILESCC.CC.CN(C)C(=O)N1CCC(O)CC1
InChIInChI=1S/C8H16N2O2.2C2H6/c1-9(2)8(12)10-5-3-7(11)4-6-10;2*1-2/h7,11H,3-6H2,1-2H3;2*1-2H3
InChIKeyRPFPQXVRQYNSFC-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.18
Rot. Bonds

About ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide

ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide (PubChem CID 177000200) has the molecular formula C12H28N2O2 and a molecular weight of 232.37 g/mol. Its IUPAC name is ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Nameethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide
PubChem CID177000200
Molecular FormulaC12H28N2O2
Molecular Weight232.37 g/mol
Exact Mass232.22
IUPAC Nameethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide
SMILESCC.CC.CN(C)C(=O)N1CCC(O)CC1
InChIInChI=1S/C8H16N2O2.2C2H6/c1-9(2)8(12)10-5-3-7(11)4-6-10;2*1-2/h7,11H,3-6H2,1-2H3;2*1-2H3
InChIKeyRPFPQXVRQYNSFC-UHFFFAOYSA-N
XLogP2.18
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide?
The IUPAC name of ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide (CID 177000200) is ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide?
The canonical SMILES for ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide is CC.CC.CN(C)C(=O)N1CCC(O)CC1.
What is the InChIKey of ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide?
The InChIKey is RPFPQXVRQYNSFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2.2C2H6/c1-9(2)8(12)10-5-3-7(11)4-6-10;2*1-2/h7,11H,3-6H2,1-2H3;2*1-2H3.
What are the key properties of ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide?
ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide has a molecular weight of 232.37 g/mol, XLogP of 2.18, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-hydroxy-N,N-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 177000200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).