[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol

C12H20N2OS — CID 106360158

IUPAC[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol
SMILESNCC(NC1CCCC1CO)c1cccs1
InChIInChI=1S/C12H20N2OS/c13-7-11(12-5-2-6-16-12)14-10-4-1-3-9(10)8-15/h2,5-6,9-11,14-15H,1,3-4,7-8,13H2
InChIKeyYFYAWXSWEIYEHX-UHFFFAOYSA-N
MW240.37 g/mol
LogP1.50
Rot. Bonds5

About [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol

[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol (PubChem CID 106360158) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol
PubChem CID106360158
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol
SMILESNCC(NC1CCCC1CO)c1cccs1
InChIInChI=1S/C12H20N2OS/c13-7-11(12-5-2-6-16-12)14-10-4-1-3-9(10)8-15/h2,5-6,9-11,14-15H,1,3-4,7-8,13H2
InChIKeyYFYAWXSWEIYEHX-UHFFFAOYSA-N
XLogP1.50
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[[2-amino-1-(2-fluorophenyl)ethyl]amino]cyclopentyl]methanol
CID 114178543
[2-[(2-amino-1-naphthalen-1-ylethyl)amino]cyclopentyl]methanol
CID 106360045
[2-[[2-amino-1-(3,4,5-trifluorophenyl)ethyl]amino]cyclopentyl]methanol
CID 106360126
[2-[[2-amino-1-[4-(2-methylpropyl)phenyl]ethyl]amino]cyclopentyl]methanol
CID 106359978
[2-(1-phenylpropylamino)cyclohexyl]methanol
CID 113261894
[2-[[2-amino-1-[2-(methoxymethyl)phenyl]ethyl]amino]cyclohexyl]methanol
CID 106360309
[2-[(1-amino-3-phenylbutan-2-yl)amino]cyclopentyl]methanol
CID 106359972
[2-[[2-amino-1-(2-chloro-6-methoxyphenyl)ethyl]amino]cyclohexyl]methanol
CID 106360404
[2-[[2-amino-1-(1-ethylpyrazol-4-yl)ethyl]amino]cyclopentyl]methanol
CID 114178568
[2-[[2-amino-1-(2-fluoro-5-methylphenyl)ethyl]amino]cyclohexyl]methanol
CID 106360487
[2-[[2-amino-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]cyclohexyl]methanol
CID 106360448
[2-[1-(3-bromophenyl)propylamino]cyclopentyl]methanol
CID 113262133

Frequently Asked Questions

What is the IUPAC name of [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol?
The IUPAC name of [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol (CID 106360158) is [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol?
The canonical SMILES for [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol is NCC(NC1CCCC1CO)c1cccs1.
What is the InChIKey of [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol?
The InChIKey is YFYAWXSWEIYEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c13-7-11(12-5-2-6-16-12)14-10-4-1-3-9(10)8-15/h2,5-6,9-11,14-15H,1,3-4,7-8,13H2.
What are the key properties of [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol?
[2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol has a molecular weight of 240.37 g/mol, XLogP of 1.50, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-amino-1-thiophen-2-ylethyl)amino]cyclopentyl]methanol is sourced from PubChem (CID 106360158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).