[1-(3-fluoropropylamino)cyclopentyl]methanol

C9H18FNO — CID 81106336

IUPAC[1-(3-fluoropropylamino)cyclopentyl]methanol
SMILESOCC1(NCCCF)CCCC1
InChIInChI=1S/C9H18FNO/c10-6-3-7-11-9(8-12)4-1-2-5-9/h11-12H,1-8H2
InChIKeyBZZVWKVYGMDSEJ-UHFFFAOYSA-N
MW175.25 g/mol
LogP1.24
Rot. Bonds5

About [1-(3-fluoropropylamino)cyclopentyl]methanol

[1-(3-fluoropropylamino)cyclopentyl]methanol (PubChem CID 81106336) has the molecular formula C9H18FNO and a molecular weight of 175.25 g/mol. Its IUPAC name is [1-(3-fluoropropylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(3-fluoropropylamino)cyclopentyl]methanol
PubChem CID81106336
Molecular FormulaC9H18FNO
Molecular Weight175.25 g/mol
Exact Mass175.14
IUPAC Name[1-(3-fluoropropylamino)cyclopentyl]methanol
SMILESOCC1(NCCCF)CCCC1
InChIInChI=1S/C9H18FNO/c10-6-3-7-11-9(8-12)4-1-2-5-9/h11-12H,1-8H2
InChIKeyBZZVWKVYGMDSEJ-UHFFFAOYSA-N
XLogP1.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.25
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoropropylamino)cyclopentyl]methanol?
The IUPAC name of [1-(3-fluoropropylamino)cyclopentyl]methanol (CID 81106336) is [1-(3-fluoropropylamino)cyclopentyl]methanol.
What is the SMILES notation for [1-(3-fluoropropylamino)cyclopentyl]methanol?
The canonical SMILES for [1-(3-fluoropropylamino)cyclopentyl]methanol is OCC1(NCCCF)CCCC1.
What is the InChIKey of [1-(3-fluoropropylamino)cyclopentyl]methanol?
The InChIKey is BZZVWKVYGMDSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18FNO/c10-6-3-7-11-9(8-12)4-1-2-5-9/h11-12H,1-8H2.
What are the key properties of [1-(3-fluoropropylamino)cyclopentyl]methanol?
[1-(3-fluoropropylamino)cyclopentyl]methanol has a molecular weight of 175.25 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoropropylamino)cyclopentyl]methanol is sourced from PubChem (CID 81106336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).