2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol

C12H19NOS — CID 60884836

IUPAC2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol
SMILESCC(NC1CCCCC1O)c1cccs1
InChIInChI=1S/C12H19NOS/c1-9(12-7-4-8-15-12)13-10-5-2-3-6-11(10)14/h4,7-11,13-14H,2-3,5-6H2,1H3
InChIKeyPGQOPCZASHHNIR-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.70
Rot. Bonds3

About 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol

2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol (PubChem CID 60884836) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol
PubChem CID60884836
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol
SMILESCC(NC1CCCCC1O)c1cccs1
InChIInChI=1S/C12H19NOS/c1-9(12-7-4-8-15-12)13-10-5-2-3-6-11(10)14/h4,7-11,13-14H,2-3,5-6H2,1H3
InChIKeyPGQOPCZASHHNIR-UHFFFAOYSA-N
XLogP2.70
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-thiophen-2-ylethylamino)cycloheptan-1-ol
CID 60909745
trans-(1R,2R)-2-[[(1S)-1-thiophen-2-ylethyl]amino]cyclopentan-1-ol
CID 102733840
2-[(2-methyl-1-thiophen-2-ylpropyl)amino]cycloheptan-1-ol
CID 54963529
2-methyl-N-[(1S)-1-thiophen-2-ylethyl]thian-3-amine
CID 81398612
2-cyclohexyl-N-[(1S)-1-thiophen-2-ylethyl]cyclohexan-1-amine
CID 81398668
N-(1-thiophen-2-ylethyl)cyclohexanamine
CID 25219735
2-(1-thiophen-2-ylethylamino)cycloheptane-1-carbonitrile
CID 62741305
2-[[(1R)-1-thiophen-2-ylethyl]amino]cycloheptane-1-carbonitrile
CID 81408481
2-[1-(1,3-thiazol-5-yl)ethylamino]cyclohexan-1-ol
CID 115720070
2-methyl-N-[(1R)-1-thiophen-2-ylethyl]thiolan-3-amine
CID 102684058
trans-(1S,2S)-2-[1-(5-methylthiophen-2-yl)ethylamino]cyclopentan-1-ol
CID 102733244
cis-(1R,2S)-2-[4-[[(1S)-1-thiophen-2-ylethyl]amino]piperidin-1-yl]cyclohexan-1-ol
CID 129432736

Frequently Asked Questions

What is the IUPAC name of 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol?
The IUPAC name of 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol (CID 60884836) is 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol.
What is the SMILES notation for 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol?
The canonical SMILES for 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol is CC(NC1CCCCC1O)c1cccs1.
What is the InChIKey of 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol?
The InChIKey is PGQOPCZASHHNIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-9(12-7-4-8-15-12)13-10-5-2-3-6-11(10)14/h4,7-11,13-14H,2-3,5-6H2,1H3.
What are the key properties of 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol?
2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol has a molecular weight of 225.36 g/mol, XLogP of 2.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-thiophen-2-ylethylamino)cyclohexan-1-ol is sourced from PubChem (CID 60884836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).