1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine

C14H24N2S — CID 79066955

IUPAC1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine
SMILESCN(C)C1(C(N)Cc2cccs2)CCCCC1
InChIInChI=1S/C14H24N2S/c1-16(2)14(8-4-3-5-9-14)13(15)11-12-7-6-10-17-12/h6-7,10,13H,3-5,8-9,11,15H2,1-2H3
InChIKeyZVDKGLAASOKXJZ-UHFFFAOYSA-N
MW252.43 g/mol
LogP2.88
Rot. Bonds4

About 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine

1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine (PubChem CID 79066955) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine
PubChem CID79066955
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine
SMILESCN(C)C1(C(N)Cc2cccs2)CCCCC1
InChIInChI=1S/C14H24N2S/c1-16(2)14(8-4-3-5-9-14)13(15)11-12-7-6-10-17-12/h6-7,10,13H,3-5,8-9,11,15H2,1-2H3
InChIKeyZVDKGLAASOKXJZ-UHFFFAOYSA-N
XLogP2.88
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-[1-(methylamino)-2-thiophen-2-ylethyl]cycloheptan-1-amine
CID 79080928
1-[1-amino-2-(furan-2-yl)ethyl]-N,N-dimethylcyclohexan-1-amine
CID 83183452
1-(1-amino-2-thiophen-3-ylethyl)-N,N-dimethylcyclopentan-1-amine
CID 79069750
1-[1-amino-2-(4-iodophenyl)ethyl]-N,N-dimethylcycloheptan-1-amine
CID 79081776
1-(1-methylcyclopentyl)-3-thiophen-2-ylpropan-1-amine
CID 115860707
1-[1-amino-2-(2-methyl-1,3-thiazol-4-yl)ethyl]-N,N-dimethylcycloheptan-1-amine
CID 79080656
1-[hydrazinyl(thiophen-2-yl)methyl]-N,N-dimethylcyclopentan-1-amine
CID 105242356
1-(1-methoxycycloheptyl)-2-thiophen-2-ylethanol
CID 116755920
1-[1-amino-2-(3,4-dimethylphenyl)ethyl]-N,N-dimethylcycloheptan-1-amine
CID 79063382
1-(1-methoxycyclohexyl)-2-thiophen-2-ylethanol
CID 116753410
1-(1-methoxycyclobutyl)-3-thiophen-2-ylpropan-2-amine
CID 103556889
1-(aminomethyl)-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)cyclopentane-1-carboxamide
CID 115435396

Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine?
The IUPAC name of 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine (CID 79066955) is 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine.
What is the SMILES notation for 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine?
The canonical SMILES for 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine is CN(C)C1(C(N)Cc2cccs2)CCCCC1.
What is the InChIKey of 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine?
The InChIKey is ZVDKGLAASOKXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-16(2)14(8-4-3-5-9-14)13(15)11-12-7-6-10-17-12/h6-7,10,13H,3-5,8-9,11,15H2,1-2H3.
What are the key properties of 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine?
1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine has a molecular weight of 252.43 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-2-thiophen-2-ylethyl)-N,N-dimethylcyclohexan-1-amine is sourced from PubChem (CID 79066955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).