1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol

C15H22FNO — CID 63821700

IUPAC1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol
SMILESCC1(CNCC(O)c2ccc(F)cc2)CCCC1
InChIInChI=1S/C15H22FNO/c1-15(8-2-3-9-15)11-17-10-14(18)12-4-6-13(16)7-5-12/h4-7,14,17-18H,2-3,8-11H2,1H3
InChIKeyHMSLARJJZMMKGU-UHFFFAOYSA-N
MW251.34 g/mol
LogP3.03
Rot. Bonds5

About 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol

1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol (PubChem CID 63821700) has the molecular formula C15H22FNO and a molecular weight of 251.34 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol
PubChem CID63821700
Molecular FormulaC15H22FNO
Molecular Weight251.34 g/mol
Exact Mass251.17
IUPAC Name1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol
SMILESCC1(CNCC(O)c2ccc(F)cc2)CCCC1
InChIInChI=1S/C15H22FNO/c1-15(8-2-3-9-15)11-17-10-14(18)12-4-6-13(16)7-5-12/h4-7,14,17-18H,2-3,8-11H2,1H3
InChIKeyHMSLARJJZMMKGU-UHFFFAOYSA-N
XLogP3.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(1-methylcyclopentyl)methylamino]-1-naphthalen-2-ylethanol
CID 63823137
1-(4-fluorophenyl)-2-(2-methylpropylamino)ethanol
CID 54594094
3-[[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]methyl]oxolan-3-ol
CID 114143445
1-(4-fluorophenyl)-2-(3-methylbutylamino)ethanol
CID 60714901
4-[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]butan-2-ol
CID 64912479
(1S)-1-(4-fluorophenyl)-2-(propan-2-ylamino)ethanol
CID 42553259
1-(2-fluorophenyl)-2-[(1-methylcyclopropyl)methylamino]ethanol
CID 107165971
1-[(1-ethylcyclopropyl)methyl]-3-[2-(4-fluorophenyl)-2-hydroxyethyl]urea
CID 111833784
1-[[[2-(3,4-difluorophenyl)-2-hydroxyethyl]amino]methyl]cycloheptan-1-ol
CID 60763044
N-[2-[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]ethyl]methanesulfonamide
CID 54938767
ethyl 1-[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]cyclopentane-1-carboxylate
CID 111334012
1-(2,6-difluorophenyl)-2-[(1,4-dimethylpiperidin-4-yl)methylamino]ethanol
CID 107163546

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol (CID 63821700) is 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol is CC1(CNCC(O)c2ccc(F)cc2)CCCC1.
What is the InChIKey of 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol?
The InChIKey is HMSLARJJZMMKGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO/c1-15(8-2-3-9-15)11-17-10-14(18)12-4-6-13(16)7-5-12/h4-7,14,17-18H,2-3,8-11H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol?
1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol has a molecular weight of 251.34 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-[(1-methylcyclopentyl)methylamino]ethanol is sourced from PubChem (CID 63821700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).