2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine

C16H28N2S — CID 79852664

IUPAC2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine
SMILESCC(c1cccs1)N(C)CC1CCCC(C)(C)C1N
InChIInChI=1S/C16H28N2S/c1-12(14-8-6-10-19-14)18(4)11-13-7-5-9-16(2,3)15(13)17/h6,8,10,12-13,15H,5,7,9,11,17H2,1-4H3
InChIKeyZYEQPVOPFHRQPG-UHFFFAOYSA-N
MW280.48 g/mol
LogP3.89
Rot. Bonds4

About 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine

2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine (PubChem CID 79852664) has the molecular formula C16H28N2S and a molecular weight of 280.48 g/mol. Its IUPAC name is 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine
PubChem CID79852664
Molecular FormulaC16H28N2S
Molecular Weight280.48 g/mol
Exact Mass280.20
IUPAC Name2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine
SMILESCC(c1cccs1)N(C)CC1CCCC(C)(C)C1N
InChIInChI=1S/C16H28N2S/c1-12(14-8-6-10-19-14)18(4)11-13-7-5-9-16(2,3)15(13)17/h6,8,10,12-13,15H,5,7,9,11,17H2,1-4H3
InChIKeyZYEQPVOPFHRQPG-UHFFFAOYSA-N
XLogP3.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.48
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine with MolForge

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Related Compounds

6-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79843106
2-methyl-2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclopentan-1-amine
CID 82767577
2,2-dimethyl-5-[[propan-2-yl(thiophen-2-ylmethyl)amino]methyl]cyclopentan-1-amine
CID 79865626
2-[[methyl(1-thiophen-2-ylethyl)amino]methyl]-N-propylcyclohexan-1-amine
CID 62616023
N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]-1-thiophen-2-ylethanamine
CID 63715865
6-[[cyclohexyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79852212
6-[[ethyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79852215
N-methyl-4-[[methyl(1-thiophen-2-ylethyl)amino]methyl]oxolan-3-amine
CID 66244987
5-[[butan-2-yl(methyl)amino]methyl]-2,2-dimethylcyclopentan-1-amine
CID 79865883
6-[[cyclobutylmethyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-amine
CID 79849427
2,2-dimethyl-6-[[methyl-[(4-methyl-1,3-thiazol-5-yl)methyl]amino]methyl]cyclohexan-1-amine
CID 79848805
1-N-methyl-1-N-(1-thiophen-2-ylethyl)cyclohexane-1,3-diamine
CID 79469682

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine (CID 79852664) is 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine is CC(c1cccs1)N(C)CC1CCCC(C)(C)C1N.
What is the InChIKey of 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is ZYEQPVOPFHRQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2S/c1-12(14-8-6-10-19-14)18(4)11-13-7-5-9-16(2,3)15(13)17/h6,8,10,12-13,15H,5,7,9,11,17H2,1-4H3.
What are the key properties of 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine?
2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 280.48 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[[methyl(1-thiophen-2-ylethyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 79852664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).