1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one

C10H16F3NO — CID 116559158

IUPAC1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one
SMILESO=C(CCC(F)(F)F)CNC1CCCC1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)6-5-9(15)7-14-8-3-1-2-4-8/h8,14H,1-7H2
InChIKeyPQLRNQGCIDRSGO-UHFFFAOYSA-N
MW223.24 g/mol
LogP2.43
Rot. Bonds5

About 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one

1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one (PubChem CID 116559158) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one.

Molecular Properties

Compound Name1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one
PubChem CID116559158
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC Name1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one
SMILESO=C(CCC(F)(F)F)CNC1CCCC1
InChIInChI=1S/C10H16F3NO/c11-10(12,13)6-5-9(15)7-14-8-3-1-2-4-8/h8,14H,1-7H2
InChIKeyPQLRNQGCIDRSGO-UHFFFAOYSA-N
XLogP2.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one?
The IUPAC name of 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one (CID 116559158) is 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one.
What is the SMILES notation for 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one?
The canonical SMILES for 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one is O=C(CCC(F)(F)F)CNC1CCCC1.
What is the InChIKey of 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one?
The InChIKey is PQLRNQGCIDRSGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3NO/c11-10(12,13)6-5-9(15)7-14-8-3-1-2-4-8/h8,14H,1-7H2.
What are the key properties of 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one?
1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one has a molecular weight of 223.24 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylamino)-5,5,5-trifluoropentan-2-one is sourced from PubChem (CID 116559158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).