4-(thiophen-2-ylmethylamino)cyclohexan-1-ol

C11H17NOS — CID 43178546

IUPAC4-(thiophen-2-ylmethylamino)cyclohexan-1-ol
SMILESOC1CCC(NCc2cccs2)CC1
InChIInChI=1S/C11H17NOS/c13-10-5-3-9(4-6-10)12-8-11-2-1-7-14-11/h1-2,7,9-10,12-13H,3-6,8H2
InChIKeyUMUCUNXPWJBBQC-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.14
Rot. Bonds3

About 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol

4-(thiophen-2-ylmethylamino)cyclohexan-1-ol (PubChem CID 43178546) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(thiophen-2-ylmethylamino)cyclohexan-1-ol
PubChem CID43178546
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name4-(thiophen-2-ylmethylamino)cyclohexan-1-ol
SMILESOC1CCC(NCc2cccs2)CC1
InChIInChI=1S/C11H17NOS/c13-10-5-3-9(4-6-10)12-8-11-2-1-7-14-11/h1-2,7,9-10,12-13H,3-6,8H2
InChIKeyUMUCUNXPWJBBQC-UHFFFAOYSA-N
XLogP2.14
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol 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

4-fluoro-N-(thiophen-2-ylmethyl)cyclohexan-1-amine
CID 130678026
N-(thiophen-2-ylmethyl)cycloheptanamine
CID 4719997
cis-(1R,3S)-3-methyl-N-(thiophen-2-ylmethyl)cyclopentan-1-amine
CID 95376419
1-(3-methylbut-2-enyl)-N-(thiophen-2-ylmethyl)piperidin-4-amine
CID 43769320
ethyl 4-(thiophen-2-ylmethylamino)cyclohexane-1-carboxylate
CID 54867048
4-(1-thiophen-2-ylpropan-2-ylamino)cyclohexan-1-ol
CID 103904586
N-[[5-(thiophen-2-ylmethoxymethyl)thiophen-2-yl]methyl]cyclopropanamine
CID 107558820
cyclopropyl-[4-(thiophen-2-ylmethylamino)piperidin-1-yl]methanone
CID 43434770
1,7,7-trimethyl-3-(thiophen-2-ylmethylamino)bicyclo[2.2.1]heptan-2-ol
CID 14559512
tert-butyl 4-(thiophen-2-ylmethylamino)piperidine-1-carboxylate
CID 43652164
1-benzyl-N-(thiophen-2-ylmethyl)piperidin-4-amine
CID 4846950
1-prop-2-enyl-N-(thiophen-2-ylmethyl)piperidin-4-amine;hydrochloride
CID 115616309

Frequently Asked Questions

What is the IUPAC name of 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol?
The IUPAC name of 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol (CID 43178546) is 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol.
What is the SMILES notation for 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol?
The canonical SMILES for 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol is OC1CCC(NCc2cccs2)CC1.
What is the InChIKey of 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol?
The InChIKey is UMUCUNXPWJBBQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c13-10-5-3-9(4-6-10)12-8-11-2-1-7-14-11/h1-2,7,9-10,12-13H,3-6,8H2.
What are the key properties of 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol?
4-(thiophen-2-ylmethylamino)cyclohexan-1-ol has a molecular weight of 211.33 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(thiophen-2-ylmethylamino)cyclohexan-1-ol is sourced from PubChem (CID 43178546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).