[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol

C14H21FN2O — CID 114178543

IUPAC[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol
SMILESNCC(NC1CCCC1CO)c1ccccc1F
InChIInChI=1S/C14H21FN2O/c15-12-6-2-1-5-11(12)14(8-16)17-13-7-3-4-10(13)9-18/h1-2,5-6,10,13-14,17-18H,3-4,7-9,16H2
InChIKeyNUFHOFDPQZJPHM-UHFFFAOYSA-N
MW252.33 g/mol
LogP1.58
Rot. Bonds5

About [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol

[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol (PubChem CID 114178543) has the molecular formula C14H21FN2O and a molecular weight of 252.33 g/mol. Its IUPAC name is [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol
PubChem CID114178543
Molecular FormulaC14H21FN2O
Molecular Weight252.33 g/mol
Exact Mass252.16
IUPAC Name[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol
SMILESNCC(NC1CCCC1CO)c1ccccc1F
InChIInChI=1S/C14H21FN2O/c15-12-6-2-1-5-11(12)14(8-16)17-13-7-3-4-10(13)9-18/h1-2,5-6,10,13-14,17-18H,3-4,7-9,16H2
InChIKeyNUFHOFDPQZJPHM-UHFFFAOYSA-N
XLogP1.58
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.33
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(2-amino-1-naphthalen-1-ylethyl)amino]cyclopentyl]methanol
CID 106360045
[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol
CID 106360487
[2-[[2-amino-1-(3,4,5-trifluorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106360126
[2-[[2-amino-1-(2,5-dichlorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106359961
[2-[[2-amino-1-[2-(methoxymethyl)phenyl]ethyl]amino]cyclohexyl]methanol
CID 106360309
[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol
CID 106360158
[2-[[2-amino-1-(2,5-dimethylphenyl)ethyl]amino]cyclopentyl]methanol
CID 106360163
[2-[[2-amino-1-(5-bromo-2-chlorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106360089
[2-[1-(2,3-difluorophenyl)ethylamino]cyclohexyl]methanol
CID 103924816
[2-[[2-amino-1-(3-fluoro-4-methoxyphenyl)ethyl]amino]cyclohexyl]methanol
CID 106360364
[2-(1-phenylpropylamino)cyclohexyl]methanol
CID 113261894
[2-[(1-amino-3-phenylbutan-2-yl)amino]cyclopentyl]methanol
CID 106359972

Frequently Asked Questions

What is the IUPAC name of [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol?
The IUPAC name of [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol (CID 114178543) is [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol?
The canonical SMILES for [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol is NCC(NC1CCCC1CO)c1ccccc1F.
What is the InChIKey of [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol?
The InChIKey is NUFHOFDPQZJPHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O/c15-12-6-2-1-5-11(12)14(8-16)17-13-7-3-4-10(13)9-18/h1-2,5-6,10,13-14,17-18H,3-4,7-9,16H2.
What are the key properties of [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol?
[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol has a molecular weight of 252.33 g/mol, XLogP of 1.58, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol is sourced from PubChem (CID 114178543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).