[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol

C16H25FN2O — CID 106360487

IUPAC[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol
SMILESCc1ccc(F)c(C(CN)NC2CCCCC2CO)c1
InChIInChI=1S/C16H25FN2O/c1-11-6-7-14(17)13(8-11)16(9-18)19-15-5-3-2-4-12(15)10-20/h6-8,12,15-16,19-20H,2-5,9-10,18H2,1H3
InChIKeyPZNSJYAKXOHKLD-UHFFFAOYSA-N
MW280.39 g/mol
LogP2.27
Rot. Bonds5

About [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol

[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol (PubChem CID 106360487) has the molecular formula C16H25FN2O and a molecular weight of 280.39 g/mol. Its IUPAC name is [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol
PubChem CID106360487
Molecular FormulaC16H25FN2O
Molecular Weight280.39 g/mol
Exact Mass280.20
IUPAC Name[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol
SMILESCc1ccc(F)c(C(CN)NC2CCCCC2CO)c1
InChIInChI=1S/C16H25FN2O/c1-11-6-7-14(17)13(8-11)16(9-18)19-15-5-3-2-4-12(15)10-20/h6-8,12,15-16,19-20H,2-5,9-10,18H2,1H3
InChIKeyPZNSJYAKXOHKLD-UHFFFAOYSA-N
XLogP2.27
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol with MolForge

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Related Compounds

[2-[[2-amino-1-(2,5-dimethylphenyl)ethyl]amino]cyclopentyl]methanol
CID 106360163
[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol
CID 114178543
[2-[[2-amino-1-(2,5-dichlorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106359961
[2-[[2-amino-1-(3,4,5-trifluorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106360126
[2-[[2-amino-1-(3-fluoro-4-methoxyphenyl)ethyl]amino]cyclohexyl]methanol
CID 106360364
[2-[1-(2,5-difluorophenyl)ethylamino]cyclohexyl]methanol
CID 103784951
[2-[[2-amino-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]cyclohexyl]methanol
CID 106360448
[2-[[2-amino-1-[2-(methoxymethyl)phenyl]ethyl]amino]cyclohexyl]methanol
CID 106360309
[2-[(2-amino-1-naphthalen-1-ylethyl)amino]cyclopentyl]methanol
CID 106360045
[2-[[2-amino-1-(5-bromo-2-chlorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106360089
[2-cyclobutyl-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105309984
[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol
CID 106360158

Frequently Asked Questions

What is the IUPAC name of [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol?
The IUPAC name of [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol (CID 106360487) is [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol?
The canonical SMILES for [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol is Cc1ccc(F)c(C(CN)NC2CCCCC2CO)c1.
What is the InChIKey of [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol?
The InChIKey is PZNSJYAKXOHKLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2O/c1-11-6-7-14(17)13(8-11)16(9-18)19-15-5-3-2-4-12(15)10-20/h6-8,12,15-16,19-20H,2-5,9-10,18H2,1H3.
What are the key properties of [2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol?
[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol has a molecular weight of 280.39 g/mol, XLogP of 2.27, 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-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol is sourced from PubChem (CID 106360487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).