1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine

C11H17NS — CID 105449555

IUPAC1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine
SMILESCCc1cc(CCC2(N)CC2)cs1
InChIInChI=1S/C11H17NS/c1-2-10-7-9(8-13-10)3-4-11(12)5-6-11/h7-8H,2-6,12H2,1H3
InChIKeyAGNIWLIFTCHTRQ-UHFFFAOYSA-N
MW195.33 g/mol
LogP2.73
Rot. Bonds4

About 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine

1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine (PubChem CID 105449555) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine
PubChem CID105449555
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC Name1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine
SMILESCCc1cc(CCC2(N)CC2)cs1
InChIInChI=1S/C11H17NS/c1-2-10-7-9(8-13-10)3-4-11(12)5-6-11/h7-8H,2-6,12H2,1H3
InChIKeyAGNIWLIFTCHTRQ-UHFFFAOYSA-N
XLogP2.73
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-thiophen-3-ylethyl)cyclopropan-1-amine
CID 66025535
1-[2-(5-methyl-3-pyridinyl)ethyl]cyclopropan-1-amine
CID 105436682
1-[2-(3,4-dimethylphenyl)ethyl]cyclopropan-1-amine
CID 83684647
1-(5-ethylthiophen-3-yl)cyclohexan-1-amine
CID 59599300
1-[2-(1,5-dimethylpyrrol-3-yl)ethyl]cyclopropan-1-amine
CID 105437764
1-[2-[4-(methoxymethyl)phenyl]ethyl]cyclopropan-1-amine
CID 105457986
[4-[2-(1-aminocyclopropyl)ethyl]phenyl]methanol
CID 105445343
2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol
CID 105457995
1-[2-(4-fluorophenyl)ethyl]cyclopropan-1-amine
CID 67420694
1-[2-(2-ethyl-1,3-oxazol-5-yl)ethyl]cyclopropan-1-amine
CID 105438866
1-[(5-ethylthiophen-3-yl)methyl]piperazine
CID 82508207
1-[2-(5-ethyl-1,2-oxazol-4-yl)ethyl]cyclopropan-1-amine
CID 105438888

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine?
The IUPAC name of 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine (CID 105449555) is 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine?
The canonical SMILES for 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine is CCc1cc(CCC2(N)CC2)cs1.
What is the InChIKey of 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine?
The InChIKey is AGNIWLIFTCHTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-2-10-7-9(8-13-10)3-4-11(12)5-6-11/h7-8H,2-6,12H2,1H3.
What are the key properties of 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine?
1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine has a molecular weight of 195.33 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-ethylthiophen-3-yl)ethyl]cyclopropan-1-amine is sourced from PubChem (CID 105449555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).