ethane;piperidine-1-carboxamide

C10H24N2O — CID 176963561

IUPACethane;piperidine-1-carboxamide
SMILESCC.CC.NC(=O)N1CCCCC1
InChIInChI=1S/C6H12N2O.2C2H6/c7-6(9)8-4-2-1-3-5-8;2*1-2/h1-5H2,(H2,7,9);2*1-2H3
InChIKeyAGLMHXKOVNVXBB-UHFFFAOYSA-N
MW188.31 g/mol
LogP2.60
Rot. Bonds

About ethane;piperidine-1-carboxamide

ethane;piperidine-1-carboxamide (PubChem CID 176963561) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is ethane;piperidine-1-carboxamide.

Molecular Properties

Compound Nameethane;piperidine-1-carboxamide
PubChem CID176963561
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Nameethane;piperidine-1-carboxamide
SMILESCC.CC.NC(=O)N1CCCCC1
InChIInChI=1S/C6H12N2O.2C2H6/c7-6(9)8-4-2-1-3-5-8;2*1-2/h1-5H2,(H2,7,9);2*1-2H3
InChIKeyAGLMHXKOVNVXBB-UHFFFAOYSA-N
XLogP2.60
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;pyrrolidine-1-carboxamide
CID 144643607
methanethiol;pyrrolidine-1-carboxamide
CID 155736349
lithium;hydride;pyrrolidine-1-carboxamide
CID 173065228
pyrazine;pyrrolidine-1-carboxamide
CID 68904578
2-oxo-2-piperidin-1-ylacetamide
CID 22394328
4-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]piperidine-1-carboxamide
CID 60932505
(E)-[amino(pyrrolidin-1-yl)methylidene]urea;ethane
CID 144947093
methyl 1-carbamoylpiperidine-3-carboxylate
CID 66776661
3-[ethyl(methyl)amino]propanoic acid;pyrrolidine-1-carboxamide
CID 68551332
3-methylpiperidine-1-carboxamide
CID 16786142
3-[bis(prop-2-enyl)amino]propanoic acid;piperidine-1-carboxamide
CID 68545523
aziridine;aziridine-1-carboxamide
CID 157196797

Frequently Asked Questions

What is the IUPAC name of ethane;piperidine-1-carboxamide?
The IUPAC name of ethane;piperidine-1-carboxamide (CID 176963561) is ethane;piperidine-1-carboxamide.
What is the SMILES notation for ethane;piperidine-1-carboxamide?
The canonical SMILES for ethane;piperidine-1-carboxamide is CC.CC.NC(=O)N1CCCCC1.
What is the InChIKey of ethane;piperidine-1-carboxamide?
The InChIKey is AGLMHXKOVNVXBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.2C2H6/c7-6(9)8-4-2-1-3-5-8;2*1-2/h1-5H2,(H2,7,9);2*1-2H3.
What are the key properties of ethane;piperidine-1-carboxamide?
ethane;piperidine-1-carboxamide has a molecular weight of 188.31 g/mol, XLogP of 2.60, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;piperidine-1-carboxamide is sourced from PubChem (CID 176963561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).