azane;cyclohexanone;ethane

C8H19NO — CID 174919946

IUPACazane;cyclohexanone;ethane
SMILESCC.N.O=C1CCCCC1
InChIInChI=1S/C6H10O.C2H6.H3N/c7-6-4-2-1-3-5-6;1-2;/h1-5H2;1-2H3;1H3
InChIKeyVKICFAQNHDHLJK-UHFFFAOYSA-N
MW145.25 g/mol
LogP2.71
Rot. Bonds

About azane;cyclohexanone;ethane

azane;cyclohexanone;ethane (PubChem CID 174919946) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is azane;cyclohexanone;ethane.

Molecular Properties

Compound Nameazane;cyclohexanone;ethane
PubChem CID174919946
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Nameazane;cyclohexanone;ethane
SMILESCC.N.O=C1CCCCC1
InChIInChI=1S/C6H10O.C2H6.H3N/c7-6-4-2-1-3-5-6;1-2;/h1-5H2;1-2H3;1H3
InChIKeyVKICFAQNHDHLJK-UHFFFAOYSA-N
XLogP2.71
TPSA52.07 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azane;cyclohexanone;ethane?
The IUPAC name of azane;cyclohexanone;ethane (CID 174919946) is azane;cyclohexanone;ethane.
What is the SMILES notation for azane;cyclohexanone;ethane?
The canonical SMILES for azane;cyclohexanone;ethane is CC.N.O=C1CCCCC1.
What is the InChIKey of azane;cyclohexanone;ethane?
The InChIKey is VKICFAQNHDHLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O.C2H6.H3N/c7-6-4-2-1-3-5-6;1-2;/h1-5H2;1-2H3;1H3.
What are the key properties of azane;cyclohexanone;ethane?
azane;cyclohexanone;ethane has a molecular weight of 145.25 g/mol, XLogP of 2.71, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;cyclohexanone;ethane is sourced from PubChem (CID 174919946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).