1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol

C9H15F4NO — CID 106292299

IUPAC1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNCC(F)(F)C(F)F)CCCC1
InChIInChI=1S/C9H15F4NO/c10-7(11)9(12,13)6-14-5-8(15)3-1-2-4-8/h7,14-15H,1-6H2
InChIKeyONTYSECNMDTJRH-UHFFFAOYSA-N
MW229.22 g/mol
LogP1.78
Rot. Bonds5

About 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol

1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol (PubChem CID 106292299) has the molecular formula C9H15F4NO and a molecular weight of 229.22 g/mol. Its IUPAC name is 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol
PubChem CID106292299
Molecular FormulaC9H15F4NO
Molecular Weight229.22 g/mol
Exact Mass229.11
IUPAC Name1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNCC(F)(F)C(F)F)CCCC1
InChIInChI=1S/C9H15F4NO/c10-7(11)9(12,13)6-14-5-8(15)3-1-2-4-8/h7,14-15H,1-6H2
InChIKeyONTYSECNMDTJRH-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.22
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1-{[(2,2,2-Trifluoroethyl)amino]methyl}cyclohexan-1-ol
CID 60899407
2,2,2-trifluoro-N-[(1-hydroxycyclopentyl)methyl]acetamide
CID 64195523
1-[(3,3,3-Trifluoropropylamino)methyl]cyclopentan-1-ol
CID 65108895
1-{[(2,2,2-Trifluoroethyl)amino]methyl}cyclopentan-1-ol
CID 65108996
1-[(2,2-Difluoroethylamino)methyl]cyclopentan-1-ol
CID 65109046
1-[[(3,3,3-Trifluoro-2-hydroxypropyl)amino]methyl]cyclopentan-1-ol
CID 65111126
1-[[2-(Trifluoromethoxy)ethylamino]methyl]cyclopentan-1-ol
CID 65805407
1-[(2-Fluoroethylamino)methyl]cyclopentan-1-ol
CID 80694379
1-[(3-Fluoropropylamino)methyl]cyclopentan-1-ol
CID 81107322
1-[(1,1-Difluoropropan-2-ylamino)methyl]cyclopentan-1-ol
CID 102869656
3,3,3-Trifluoro-2-[[(1-hydroxycyclopentyl)methylamino]methyl]propanenitrile
CID 103367341
2,2,3,3-tetrafluoro-N-[(1-hydroxycyclopentyl)methyl]propanamide
CID 103733802

Frequently Asked Questions

What is the IUPAC name of 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol (CID 106292299) is 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol is OC1(CNCC(F)(F)C(F)F)CCCC1.
What is the InChIKey of 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol?
The InChIKey is ONTYSECNMDTJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15F4NO/c10-7(11)9(12,13)6-14-5-8(15)3-1-2-4-8/h7,14-15H,1-6H2.
What are the key properties of 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol?
1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol has a molecular weight of 229.22 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,2,3,3-tetrafluoropropylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 106292299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).