1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine

C7H11NS — CID 129056511

IUPAC1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine
SMILESNC1(C2CC=CS2)CC1
InChIInChI=1S/C7H11NS/c8-7(3-4-7)6-2-1-5-9-6/h1,5-6H,2-4,8H2
InChIKeyNERPNOJACRSAPG-UHFFFAOYSA-N
MW141.24 g/mol
LogP1.50
Rot. Bonds1

About 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine

1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine (PubChem CID 129056511) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine.

Molecular Properties

Compound Name1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine
PubChem CID129056511
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Name1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine
SMILESNC1(C2CC=CS2)CC1
InChIInChI=1S/C7H11NS/c8-7(3-4-7)6-2-1-5-9-6/h1,5-6H,2-4,8H2
InChIKeyNERPNOJACRSAPG-UHFFFAOYSA-N
XLogP1.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine?
The IUPAC name of 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine (CID 129056511) is 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine.
What is the SMILES notation for 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine?
The canonical SMILES for 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine is NC1(C2CC=CS2)CC1.
What is the InChIKey of 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine?
The InChIKey is NERPNOJACRSAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NS/c8-7(3-4-7)6-2-1-5-9-6/h1,5-6H,2-4,8H2.
What are the key properties of 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine?
1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine has a molecular weight of 141.24 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrothiophen-2-yl)cyclopropan-1-amine is sourced from PubChem (CID 129056511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).