(2-thiomorpholin-4-ylcyclohexyl)methanamine

C11H22N2S — CID 43530820

IUPAC(2-thiomorpholin-4-ylcyclohexyl)methanamine
SMILESNCC1CCCCC1N1CCSCC1
InChIInChI=1S/C11H22N2S/c12-9-10-3-1-2-4-11(10)13-5-7-14-8-6-13/h10-11H,1-9,12H2
InChIKeyWCDZJQWXEXKJIO-UHFFFAOYSA-N
MW214.38 g/mol
LogP1.55
Rot. Bonds2

About (2-thiomorpholin-4-ylcyclohexyl)methanamine

(2-thiomorpholin-4-ylcyclohexyl)methanamine (PubChem CID 43530820) has the molecular formula C11H22N2S and a molecular weight of 214.38 g/mol. Its IUPAC name is (2-thiomorpholin-4-ylcyclohexyl)methanamine.

Molecular Properties

Compound Name(2-thiomorpholin-4-ylcyclohexyl)methanamine
PubChem CID43530820
Molecular FormulaC11H22N2S
Molecular Weight214.38 g/mol
Exact Mass214.15
IUPAC Name(2-thiomorpholin-4-ylcyclohexyl)methanamine
SMILESNCC1CCCCC1N1CCSCC1
InChIInChI=1S/C11H22N2S/c12-9-10-3-1-2-4-11(10)13-5-7-14-8-6-13/h10-11H,1-9,12H2
InChIKeyWCDZJQWXEXKJIO-UHFFFAOYSA-N
XLogP1.55
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(Thiomorpholin-4-yl)cyclohexyl]methanamine
CID 28787090
N-(2-thiomorpholin-4-ylethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 104934268
2-(1-Thiomorpholin-4-ylcyclohexyl)ethanamine
CID 10561358
4-(4-Piperidin-4-ylbutyl)thiomorpholine
CID 54029630
N,N-dimethyl-1-(4-thiomorpholin-4-ylcyclohexyl)methanamine
CID 144209418
2-[1-[(4-Methylsulfanylcyclohexyl)methyl]piperidin-4-yl]ethanamine
CID 167091255
1-[[4-(Iodoamino)cyclohexyl]methyl]piperidine-4-thiol
CID 175622742
1-(Thiomorpholinomethyl)cyclohexan-1-amine
CID 28787571
2-Cyclohexyl-2-thiomorpholin-4-ylethanamine
CID 43210656
N-(cyclohexylmethyl)thian-4-amine
CID 43394824
N-(2-methylcyclohexyl)thian-4-amine
CID 43394867
N-(2-ethylcyclohexyl)thian-4-amine
CID 43434146

Frequently Asked Questions

What is the IUPAC name of (2-thiomorpholin-4-ylcyclohexyl)methanamine?
The IUPAC name of (2-thiomorpholin-4-ylcyclohexyl)methanamine (CID 43530820) is (2-thiomorpholin-4-ylcyclohexyl)methanamine.
What is the SMILES notation for (2-thiomorpholin-4-ylcyclohexyl)methanamine?
The canonical SMILES for (2-thiomorpholin-4-ylcyclohexyl)methanamine is NCC1CCCCC1N1CCSCC1.
What is the InChIKey of (2-thiomorpholin-4-ylcyclohexyl)methanamine?
The InChIKey is WCDZJQWXEXKJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2S/c12-9-10-3-1-2-4-11(10)13-5-7-14-8-6-13/h10-11H,1-9,12H2.
What are the key properties of (2-thiomorpholin-4-ylcyclohexyl)methanamine?
(2-thiomorpholin-4-ylcyclohexyl)methanamine has a molecular weight of 214.38 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-thiomorpholin-4-ylcyclohexyl)methanamine is sourced from PubChem (CID 43530820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).