(1-aminocyclopentyl)-(3-fluorophenyl)methanone

C12H14FNO — CID 82283406

IUPAC(1-aminocyclopentyl)-(3-fluorophenyl)methanone
SMILESNC1(C(=O)c2cccc(F)c2)CCCC1
InChIInChI=1S/C12H14FNO/c13-10-5-3-4-9(8-10)11(15)12(14)6-1-2-7-12/h3-5,8H,1-2,6-7,14H2
InChIKeyXLYNSTNKXSIAKL-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.28
Rot. Bonds2

About (1-aminocyclopentyl)-(3-fluorophenyl)methanone

(1-aminocyclopentyl)-(3-fluorophenyl)methanone (PubChem CID 82283406) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is (1-aminocyclopentyl)-(3-fluorophenyl)methanone.

Molecular Properties

Compound Name(1-aminocyclopentyl)-(3-fluorophenyl)methanone
PubChem CID82283406
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name(1-aminocyclopentyl)-(3-fluorophenyl)methanone
SMILESNC1(C(=O)c2cccc(F)c2)CCCC1
InChIInChI=1S/C12H14FNO/c13-10-5-3-4-9(8-10)11(15)12(14)6-1-2-7-12/h3-5,8H,1-2,6-7,14H2
InChIKeyXLYNSTNKXSIAKL-UHFFFAOYSA-N
XLogP2.28
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cathinone
CID 62258
Ethanone, 2-amino-1-phenyl-, hydrochloride (1:1)
CID 2723597
Cathinone hydrochloride
CID 11956149
(-)-alpha-Amino-propiophenone
CID 107786
Phenacylamine
CID 11952
2-Amino-1-phenylpropan-1-one;hydrochloride
CID 204630
4-Fluoromethcathinone
CID 49853406
3'-Fluoromethcathinone
CID 53415330
2-(Tert-butylamino)-1-(3-fluorophenyl)propan-1-one
CID 215051
4-Fluoropentedrone
CID 132278123
2-(N-Cyclopentylamino)-3''-fluoropropiophenone
CID 45141379
Phenylglyoxylic acid amide
CID 82018

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopentyl)-(3-fluorophenyl)methanone?
The IUPAC name of (1-aminocyclopentyl)-(3-fluorophenyl)methanone (CID 82283406) is (1-aminocyclopentyl)-(3-fluorophenyl)methanone.
What is the SMILES notation for (1-aminocyclopentyl)-(3-fluorophenyl)methanone?
The canonical SMILES for (1-aminocyclopentyl)-(3-fluorophenyl)methanone is NC1(C(=O)c2cccc(F)c2)CCCC1.
What is the InChIKey of (1-aminocyclopentyl)-(3-fluorophenyl)methanone?
The InChIKey is XLYNSTNKXSIAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c13-10-5-3-4-9(8-10)11(15)12(14)6-1-2-7-12/h3-5,8H,1-2,6-7,14H2.
What are the key properties of (1-aminocyclopentyl)-(3-fluorophenyl)methanone?
(1-aminocyclopentyl)-(3-fluorophenyl)methanone has a molecular weight of 207.25 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopentyl)-(3-fluorophenyl)methanone is sourced from PubChem (CID 82283406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).