N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine

C15H25NS — CID 65246386

IUPACN-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine
SMILESCCC1CCCCC1NCc1cc(C)c(C)s1
InChIInChI=1S/C15H25NS/c1-4-13-7-5-6-8-15(13)16-10-14-9-11(2)12(3)17-14/h9,13,15-16H,4-8,10H2,1-3H3
InChIKeyHRAZDWBLZGSOGK-UHFFFAOYSA-N
MW251.44 g/mol
LogP4.42
Rot. Bonds4

About N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine

N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine (PubChem CID 65246386) has the molecular formula C15H25NS and a molecular weight of 251.44 g/mol. Its IUPAC name is N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine
PubChem CID65246386
Molecular FormulaC15H25NS
Molecular Weight251.44 g/mol
Exact Mass251.17
IUPAC NameN-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine
SMILESCCC1CCCCC1NCc1cc(C)c(C)s1
InChIInChI=1S/C15H25NS/c1-4-13-7-5-6-8-15(13)16-10-14-9-11(2)12(3)17-14/h9,13,15-16H,4-8,10H2,1-3H3
InChIKeyHRAZDWBLZGSOGK-UHFFFAOYSA-N
XLogP4.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.44
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-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

N-[(4,5-dimethylthiophen-2-yl)methyl]-2-methylcyclobutan-1-amine
CID 130171661
N-[(4-chlorothiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine
CID 79419374
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 79545102
N-[(3,5-dimethylphenyl)methyl]-2-ethylcyclohexan-1-amine
CID 55200279
2-[[(4,5-dimethylthiophen-2-yl)methylamino]methyl]cyclohexan-1-amine
CID 65241356
N-[(4-bromo-5-methylthiophen-2-yl)methyl]-2-methylcycloheptan-1-amine
CID 102836225
5-[[(2-ethylcyclohexyl)amino]methyl]thiophene-3-carbonitrile
CID 79545724
N-[(4,5-dimethylthiophen-2-yl)methyl]thian-4-amine
CID 65246378
2-ethyl-N-(1,3-thiazol-5-ylmethyl)cyclopentan-1-amine
CID 115732788
2-ethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclopentan-1-amine
CID 115724522
N-[(4-bromo-5-methylthiophen-2-yl)methyl]-2-methylsulfanylcyclohexan-1-amine
CID 114122323
N-benzyl-2-ethylcyclohexan-1-amine
CID 43434056

Frequently Asked Questions

What is the IUPAC name of N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine?
The IUPAC name of N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine (CID 65246386) is N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine.
What is the SMILES notation for N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine?
The canonical SMILES for N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine is CCC1CCCCC1NCc1cc(C)c(C)s1.
What is the InChIKey of N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine?
The InChIKey is HRAZDWBLZGSOGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NS/c1-4-13-7-5-6-8-15(13)16-10-14-9-11(2)12(3)17-14/h9,13,15-16H,4-8,10H2,1-3H3.
What are the key properties of N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine?
N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine has a molecular weight of 251.44 g/mol, XLogP of 4.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,5-dimethylthiophen-2-yl)methyl]-2-ethylcyclohexan-1-amine is sourced from PubChem (CID 65246386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).