2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine

C10H15NS — CID 82408063

IUPAC2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine
SMILESNCCc1ccc(CC2CC2)s1
InChIInChI=1S/C10H15NS/c11-6-5-9-3-4-10(12-9)7-8-1-2-8/h3-4,8H,1-2,5-7,11H2
InChIKeyLIZVZEGPHKZBLQ-UHFFFAOYSA-N
MW181.30 g/mol
LogP2.20
Rot. Bonds4

About 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine

2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine (PubChem CID 82408063) has the molecular formula C10H15NS and a molecular weight of 181.30 g/mol. Its IUPAC name is 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine.

Molecular Properties

Compound Name2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine
PubChem CID82408063
Molecular FormulaC10H15NS
Molecular Weight181.30 g/mol
Exact Mass181.09
IUPAC Name2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine
SMILESNCCc1ccc(CC2CC2)s1
InChIInChI=1S/C10H15NS/c11-6-5-9-3-4-10(12-9)7-8-1-2-8/h3-4,8H,1-2,5-7,11H2
InChIKeyLIZVZEGPHKZBLQ-UHFFFAOYSA-N
XLogP2.20
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine?
The IUPAC name of 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine (CID 82408063) is 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine.
What is the SMILES notation for 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine?
The canonical SMILES for 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine is NCCc1ccc(CC2CC2)s1.
What is the InChIKey of 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine?
The InChIKey is LIZVZEGPHKZBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NS/c11-6-5-9-3-4-10(12-9)7-8-1-2-8/h3-4,8H,1-2,5-7,11H2.
What are the key properties of 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine?
2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine has a molecular weight of 181.30 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(cyclopropylmethyl)thiophen-2-yl]ethanamine is sourced from PubChem (CID 82408063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).