N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine

C17H30N2S — CID 79074622

IUPACN,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine
SMILESCNC(CCc1ccsc1)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C17H30N2S/c1-14-6-5-10-17(12-14,19(3)4)16(18-2)8-7-15-9-11-20-13-15/h9,11,13-14,16,18H,5-8,10,12H2,1-4H3
InChIKeyHAOJFLZHMRHCPZ-UHFFFAOYSA-N
MW294.51 g/mol
LogP3.78
Rot. Bonds6

About N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine

N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine (PubChem CID 79074622) has the molecular formula C17H30N2S and a molecular weight of 294.51 g/mol. Its IUPAC name is N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine
PubChem CID79074622
Molecular FormulaC17H30N2S
Molecular Weight294.51 g/mol
Exact Mass294.21
IUPAC NameN,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine
SMILESCNC(CCc1ccsc1)C1(N(C)C)CCCC(C)C1
InChIInChI=1S/C17H30N2S/c1-14-6-5-10-17(12-14,19(3)4)16(18-2)8-7-15-9-11-20-13-15/h9,11,13-14,16,18H,5-8,10,12H2,1-4H3
InChIKeyHAOJFLZHMRHCPZ-UHFFFAOYSA-N
XLogP3.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.51
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-amino-3-thiophen-3-ylpropyl)-N,N,3-trimethylcyclohexan-1-amine
CID 79074834
N,N-dimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cycloheptan-1-amine
CID 79080663
N,N,3-trimethyl-1-[1-(methylamino)-3-(1-methylpyrazol-4-yl)propyl]cyclohexan-1-amine
CID 103011187
1-[2-(4-chlorophenyl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79062833
1-[1-(ethylamino)-3-thiophen-3-ylpropyl]-N,N-dimethylcycloheptan-1-amine
CID 79064190
1-[1-(ethylamino)-3-thiophen-3-ylpropyl]-N,N-dimethylcyclohexan-1-amine
CID 79066376
N,N,3-trimethyl-1-[1-(methylamino)hex-5-enyl]cyclohexan-1-amine
CID 79074031
N,N,3-trimethyl-1-[1-(methylamino)but-3-ynyl]cyclohexan-1-amine
CID 79074998
1-(1-methoxycyclopentyl)-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 113432820
1-(1-ethoxy-3-methylcyclohexyl)-3-thiophen-3-ylpropan-1-amine
CID 116768130
1-[3-ethyl-1-(methylamino)heptyl]-N,N,3-trimethylcyclohexan-1-amine
CID 79063346
1-[2-(5-bromo-2-pyridinyl)-1-(methylamino)ethyl]-N,N,3-trimethylcyclohexan-1-amine
CID 104803076

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine?
The IUPAC name of N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine (CID 79074622) is N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine.
What is the SMILES notation for N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine?
The canonical SMILES for N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine is CNC(CCc1ccsc1)C1(N(C)C)CCCC(C)C1.
What is the InChIKey of N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine?
The InChIKey is HAOJFLZHMRHCPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2S/c1-14-6-5-10-17(12-14,19(3)4)16(18-2)8-7-15-9-11-20-13-15/h9,11,13-14,16,18H,5-8,10,12H2,1-4H3.
What are the key properties of N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine?
N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine has a molecular weight of 294.51 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-1-[1-(methylamino)-3-thiophen-3-ylpropyl]cyclohexan-1-amine is sourced from PubChem (CID 79074622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).