2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine

C13H26N2S — CID 62573622

IUPAC2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine
SMILESCC1CCCCC1NCCN1CCSCC1
InChIInChI=1S/C13H26N2S/c1-12-4-2-3-5-13(12)14-6-7-15-8-10-16-11-9-15/h12-14H,2-11H2,1H3
InChIKeyQYCLTYGVMQZIRJ-UHFFFAOYSA-N
MW242.43 g/mol
LogP2.20
Rot. Bonds4

About 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine

2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine (PubChem CID 62573622) has the molecular formula C13H26N2S and a molecular weight of 242.43 g/mol. Its IUPAC name is 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine
PubChem CID62573622
Molecular FormulaC13H26N2S
Molecular Weight242.43 g/mol
Exact Mass242.18
IUPAC Name2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine
SMILESCC1CCCCC1NCCN1CCSCC1
InChIInChI=1S/C13H26N2S/c1-12-4-2-3-5-13(12)14-6-7-15-8-10-16-11-9-15/h12-14H,2-11H2,1H3
InChIKeyQYCLTYGVMQZIRJ-UHFFFAOYSA-N
XLogP2.20
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1R,2R)-2-methyl-N-(2-piperidin-1-ylethyl)cyclopentan-1-amine
CID 96923223
2-methyl-N-(2-morpholin-4-ylethyl)cyclohexan-1-amine
CID 4711849
trans-(1S,2S)-2-(2-thiomorpholin-4-ylethylamino)cyclohexan-1-ol
CID 106325588
N-(2-thiomorpholin-4-ylethyl)cyclopentanamine
CID 60849284
N-(2-thiomorpholin-4-ylethyl)cyclohexanamine
CID 62573834
N-[2-[4-(methoxymethyl)piperidin-1-yl]ethyl]-2-methylcyclohexan-1-amine
CID 63978745
3,4-dimethyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine
CID 104854192
N-(2-thiomorpholin-4-ylethyl)bicyclo[2.2.1]heptan-2-amine
CID 115886340
N-[2-(2,3-dimethylpiperidin-1-yl)ethyl]-2-methylcyclohexan-1-amine
CID 62561600
4-methyl-N-(2-thiomorpholin-4-ylethyl)cycloheptan-1-amine
CID 114173727
N-(2-thiomorpholin-4-ylethyl)thian-4-amine
CID 115623278
N-[2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)ethyl]-2-methylcyclohexan-1-amine
CID 79945993

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine (CID 62573622) is 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine is CC1CCCCC1NCCN1CCSCC1.
What is the InChIKey of 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine?
The InChIKey is QYCLTYGVMQZIRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2S/c1-12-4-2-3-5-13(12)14-6-7-15-8-10-16-11-9-15/h12-14H,2-11H2,1H3.
What are the key properties of 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine?
2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine has a molecular weight of 242.43 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-thiomorpholin-4-ylethyl)cyclohexan-1-amine is sourced from PubChem (CID 62573622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).