4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one

C15H23NOS — CID 62614034

IUPAC4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one
SMILESCC1CCC(=O)C(CN(C)C(C)c2cccs2)C1
InChIInChI=1S/C15H23NOS/c1-11-6-7-14(17)13(9-11)10-16(3)12(2)15-5-4-8-18-15/h4-5,8,11-13H,6-7,9-10H2,1-3H3
InChIKeyZSDUMXOGPALFTR-UHFFFAOYSA-N
MW265.42 g/mol
LogP3.75
Rot. Bonds4

About 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one

4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one (PubChem CID 62614034) has the molecular formula C15H23NOS and a molecular weight of 265.42 g/mol. Its IUPAC name is 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one.

Molecular Properties

Compound Name4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one
PubChem CID62614034
Molecular FormulaC15H23NOS
Molecular Weight265.42 g/mol
Exact Mass265.15
IUPAC Name4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one
SMILESCC1CCC(=O)C(CN(C)C(C)c2cccs2)C1
InChIInChI=1S/C15H23NOS/c1-11-6-7-14(17)13(9-11)10-16(3)12(2)15-5-4-8-18-15/h4-5,8,11-13H,6-7,9-10H2,1-3H3
InChIKeyZSDUMXOGPALFTR-UHFFFAOYSA-N
XLogP3.75
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.42
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one with MolForge

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Related Compounds

2-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]-4-propan-2-ylcyclohexan-1-one
CID 79489426
4-methyl-2-[[methyl(oxan-4-yl)amino]methyl]cyclohexan-1-one
CID 62612208
2-[[(3-fluorophenyl)methyl-methylamino]methyl]-4-methylcyclohexan-1-one
CID 62612853
2-[[butan-2-yl(ethyl)amino]methyl]-4-methylcyclohexan-1-one
CID 62612028
2-[methyl(1-thiophen-2-ylethyl)amino]cycloheptan-1-one
CID 55134907
N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]-1-thiophen-2-ylethanamine
CID 63715865
4-propan-2-yl-2-[[propan-2-yl(thiophen-2-ylmethyl)amino]methyl]cyclohexan-1-one
CID 62703961
4-methyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexan-1-one
CID 62613387
2-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]-4-ethylcyclohexan-1-one
CID 63484465
2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine
CID 79852664
2-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclopentan-1-amine
CID 82767577
4-ethyl-2-[[methyl(thiophen-2-ylmethyl)amino]methyl]cyclohexan-1-one
CID 62612203

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one?
The IUPAC name of 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one (CID 62614034) is 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one.
What is the SMILES notation for 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one?
The canonical SMILES for 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one is CC1CCC(=O)C(CN(C)C(C)c2cccs2)C1.
What is the InChIKey of 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one?
The InChIKey is ZSDUMXOGPALFTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NOS/c1-11-6-7-14(17)13(9-11)10-16(3)12(2)15-5-4-8-18-15/h4-5,8,11-13H,6-7,9-10H2,1-3H3.
What are the key properties of 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one?
4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one has a molecular weight of 265.42 g/mol, XLogP of 3.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-one is sourced from PubChem (CID 62614034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).