2-propyl-2,3-dihydrothiophen-3-amine

C7H13NS — CID 57119299

IUPAC2-propyl-2,3-dihydrothiophen-3-amine
SMILESCCCC1SC=CC1N
InChIInChI=1S/C7H13NS/c1-2-3-7-6(8)4-5-9-7/h4-7H,2-3,8H2,1H3
InChIKeyKLUCUNZBFCYSBC-UHFFFAOYSA-N
MW143.25 g/mol
LogP1.74
Rot. Bonds2

About 2-propyl-2,3-dihydrothiophen-3-amine

2-propyl-2,3-dihydrothiophen-3-amine (PubChem CID 57119299) has the molecular formula C7H13NS and a molecular weight of 143.25 g/mol. Its IUPAC name is 2-propyl-2,3-dihydrothiophen-3-amine.

Molecular Properties

Compound Name2-propyl-2,3-dihydrothiophen-3-amine
PubChem CID57119299
Molecular FormulaC7H13NS
Molecular Weight143.25 g/mol
Exact Mass143.08
IUPAC Name2-propyl-2,3-dihydrothiophen-3-amine
SMILESCCCC1SC=CC1N
InChIInChI=1S/C7H13NS/c1-2-3-7-6(8)4-5-9-7/h4-7H,2-3,8H2,1H3
InChIKeyKLUCUNZBFCYSBC-UHFFFAOYSA-N
XLogP1.74
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.25
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-6-methylsulfanylhex-5-en-2-amine
CID 55283837
N-ethyl-2-propyl-2,3-dihydrothiophen-3-amine
CID 54101904
N,2-dipropyl-2,3-dihydrothiophen-3-amine
CID 54478450
2-(2,3-Dihydrothiophen-2-yl)ethanamine
CID 70315620
(3S)-4-methylidene-1-methylsulfanylhept-6-en-3-amine
CID 88850658
(3S)-5-methylsulfanylpent-1-en-3-amine
CID 88911302
1-(2,3-Dihydrothiophen-2-yl)propan-1-amine
CID 89098961
(1S)-1-(2,3-dihydrothiophen-2-yl)propan-1-amine
CID 89098963
1-(2,3-Dihydrothiophen-2-yl)butan-1-amine
CID 89098969
(1R)-1-(2,3-dihydrothiophen-4-yl)propan-1-amine
CID 89126086
(1R)-1-(2,3-dihydrothiophen-2-yl)propan-1-amine
CID 89205609
(1S)-1-(2,3-dihydrothiophen-2-yl)ethanamine
CID 89246156

Frequently Asked Questions

What is the IUPAC name of 2-propyl-2,3-dihydrothiophen-3-amine?
The IUPAC name of 2-propyl-2,3-dihydrothiophen-3-amine (CID 57119299) is 2-propyl-2,3-dihydrothiophen-3-amine.
What is the SMILES notation for 2-propyl-2,3-dihydrothiophen-3-amine?
The canonical SMILES for 2-propyl-2,3-dihydrothiophen-3-amine is CCCC1SC=CC1N.
What is the InChIKey of 2-propyl-2,3-dihydrothiophen-3-amine?
The InChIKey is KLUCUNZBFCYSBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NS/c1-2-3-7-6(8)4-5-9-7/h4-7H,2-3,8H2,1H3.
What are the key properties of 2-propyl-2,3-dihydrothiophen-3-amine?
2-propyl-2,3-dihydrothiophen-3-amine has a molecular weight of 143.25 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-2,3-dihydrothiophen-3-amine is sourced from PubChem (CID 57119299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).