2-chloro-4-cyclopentylthiophen-3-amine

C9H12ClNS — CID 114749369

IUPAC2-chloro-4-cyclopentylthiophen-3-amine
SMILESNc1c(C2CCCC2)csc1Cl
InChIInChI=1S/C9H12ClNS/c10-9-8(11)7(5-12-9)6-3-1-2-4-6/h5-6H,1-4,11H2
InChIKeySALOUWYHJCMJLC-UHFFFAOYSA-N
MW201.72 g/mol
LogP3.64
Rot. Bonds1

About 2-chloro-4-cyclopentylthiophen-3-amine

2-chloro-4-cyclopentylthiophen-3-amine (PubChem CID 114749369) has the molecular formula C9H12ClNS and a molecular weight of 201.72 g/mol. Its IUPAC name is 2-chloro-4-cyclopentylthiophen-3-amine.

Molecular Properties

Compound Name2-chloro-4-cyclopentylthiophen-3-amine
PubChem CID114749369
Molecular FormulaC9H12ClNS
Molecular Weight201.72 g/mol
Exact Mass201.04
IUPAC Name2-chloro-4-cyclopentylthiophen-3-amine
SMILESNc1c(C2CCCC2)csc1Cl
InChIInChI=1S/C9H12ClNS/c10-9-8(11)7(5-12-9)6-3-1-2-4-6/h5-6H,1-4,11H2
InChIKeySALOUWYHJCMJLC-UHFFFAOYSA-N
XLogP3.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.72
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-cyclopentylthiophen-3-amine?
The IUPAC name of 2-chloro-4-cyclopentylthiophen-3-amine (CID 114749369) is 2-chloro-4-cyclopentylthiophen-3-amine.
What is the SMILES notation for 2-chloro-4-cyclopentylthiophen-3-amine?
The canonical SMILES for 2-chloro-4-cyclopentylthiophen-3-amine is Nc1c(C2CCCC2)csc1Cl.
What is the InChIKey of 2-chloro-4-cyclopentylthiophen-3-amine?
The InChIKey is SALOUWYHJCMJLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClNS/c10-9-8(11)7(5-12-9)6-3-1-2-4-6/h5-6H,1-4,11H2.
What are the key properties of 2-chloro-4-cyclopentylthiophen-3-amine?
2-chloro-4-cyclopentylthiophen-3-amine has a molecular weight of 201.72 g/mol, XLogP of 3.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-cyclopentylthiophen-3-amine is sourced from PubChem (CID 114749369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).