3-(dimethylamino)cyclopentan-1-one;ethane

C9H19NO — CID 143918821

IUPAC3-(dimethylamino)cyclopentan-1-one;ethane
SMILESCC.CN(C)C1CCC(=O)C1
InChIInChI=1S/C7H13NO.C2H6/c1-8(2)6-3-4-7(9)5-6;1-2/h6H,3-5H2,1-2H3;1-2H3
InChIKeySONKRYUSHJBZFV-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.70
Rot. Bonds1

About 3-(dimethylamino)cyclopentan-1-one;ethane

3-(dimethylamino)cyclopentan-1-one;ethane (PubChem CID 143918821) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 3-(dimethylamino)cyclopentan-1-one;ethane.

Molecular Properties

Compound Name3-(dimethylamino)cyclopentan-1-one;ethane
PubChem CID143918821
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name3-(dimethylamino)cyclopentan-1-one;ethane
SMILESCC.CN(C)C1CCC(=O)C1
InChIInChI=1S/C7H13NO.C2H6/c1-8(2)6-3-4-7(9)5-6;1-2/h6H,3-5H2,1-2H3;1-2H3
InChIKeySONKRYUSHJBZFV-UHFFFAOYSA-N
XLogP1.70
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)cyclopentan-1-one;ethane?
The IUPAC name of 3-(dimethylamino)cyclopentan-1-one;ethane (CID 143918821) is 3-(dimethylamino)cyclopentan-1-one;ethane.
What is the SMILES notation for 3-(dimethylamino)cyclopentan-1-one;ethane?
The canonical SMILES for 3-(dimethylamino)cyclopentan-1-one;ethane is CC.CN(C)C1CCC(=O)C1.
What is the InChIKey of 3-(dimethylamino)cyclopentan-1-one;ethane?
The InChIKey is SONKRYUSHJBZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO.C2H6/c1-8(2)6-3-4-7(9)5-6;1-2/h6H,3-5H2,1-2H3;1-2H3.
What are the key properties of 3-(dimethylamino)cyclopentan-1-one;ethane?
3-(dimethylamino)cyclopentan-1-one;ethane has a molecular weight of 157.26 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)cyclopentan-1-one;ethane is sourced from PubChem (CID 143918821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).