N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine

C8H15NS — CID 66792279

IUPACN-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine
SMILESCNC(C)C1CC(C)=CS1
InChIInChI=1S/C8H15NS/c1-6-4-8(10-5-6)7(2)9-3/h5,7-9H,4H2,1-3H3
InChIKeyBTOYTUJCLUJVHG-UHFFFAOYSA-N
MW157.28 g/mol
LogP2.00
Rot. Bonds2

About N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine

N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine (PubChem CID 66792279) has the molecular formula C8H15NS and a molecular weight of 157.28 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine
PubChem CID66792279
Molecular FormulaC8H15NS
Molecular Weight157.28 g/mol
Exact Mass157.09
IUPAC NameN-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine
SMILESCNC(C)C1CC(C)=CS1
InChIInChI=1S/C8H15NS/c1-6-4-8(10-5-6)7(2)9-3/h5,7-9H,4H2,1-3H3
InChIKeyBTOYTUJCLUJVHG-UHFFFAOYSA-N
XLogP2.00
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

2-Methyl-2-(3-methylbut-3-en-1-yl)-1,3-thiazolidine
CID 3058781
N-ethyl-2-propyl-2,3-dihydrothiophen-3-amine
CID 54101904
N,2-dipropyl-2,3-dihydrothiophen-3-amine
CID 54478450
(3S)-N,2-dimethyl-5-methylsulfanylpent-1-en-3-amine
CID 87501099
(3S)-N-ethyl-2-methyl-5-methylsulfanylpent-1-en-3-amine
CID 88539134
(3S)-N-methyl-4-methylidene-1-methylsulfanylhexan-3-amine
CID 88543586
(3S)-N,5-dimethyl-4-methylidene-1-methylsulfanylhexan-3-amine
CID 88936056
(3S)-2-methyl-5-methylsulfanyl-N-[(2R)-pentan-2-yl]pent-1-en-3-amine
CID 89062407
(1R)-1-(2,3-dihydrothiophen-4-yl)propan-1-amine
CID 89126086
(3S)-N-ethynyl-2-methyl-5-methylsulfanylpent-1-en-3-amine
CID 89146385
(2S)-3-methylidene-2-(2-methylsulfanylethyl)piperidine
CID 89180058
(3S)-N-ethyl-5-methyl-4-methylidene-1-methylsulfanylhex-5-en-3-amine
CID 89215267

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine?
The IUPAC name of N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine (CID 66792279) is N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine?
The canonical SMILES for N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine is CNC(C)C1CC(C)=CS1.
What is the InChIKey of N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine?
The InChIKey is BTOYTUJCLUJVHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NS/c1-6-4-8(10-5-6)7(2)9-3/h5,7-9H,4H2,1-3H3.
What are the key properties of N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine?
N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine has a molecular weight of 157.28 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methyl-2,3-dihydrothiophen-2-yl)ethanamine is sourced from PubChem (CID 66792279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).