1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine

C10H10ClNOS — CID 130905664

IUPAC1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine
SMILESCNC(c1ccoc1)c1csc(Cl)c1
InChIInChI=1S/C10H10ClNOS/c1-12-10(7-2-3-13-5-7)8-4-9(11)14-6-8/h2-6,10,12H,1H3
InChIKeyHLOBACABAPUTOK-UHFFFAOYSA-N
MW227.72 g/mol
LogP3.30
Rot. Bonds3

About 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine

1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine (PubChem CID 130905664) has the molecular formula C10H10ClNOS and a molecular weight of 227.72 g/mol. Its IUPAC name is 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine
PubChem CID130905664
Molecular FormulaC10H10ClNOS
Molecular Weight227.72 g/mol
Exact Mass227.02
IUPAC Name1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine
SMILESCNC(c1ccoc1)c1csc(Cl)c1
InChIInChI=1S/C10H10ClNOS/c1-12-10(7-2-3-13-5-7)8-4-9(11)14-6-8/h2-6,10,12H,1H3
InChIKeyHLOBACABAPUTOK-UHFFFAOYSA-N
XLogP3.30
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.72
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine (CID 130905664) is 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine is CNC(c1ccoc1)c1csc(Cl)c1.
What is the InChIKey of 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine?
The InChIKey is HLOBACABAPUTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClNOS/c1-12-10(7-2-3-13-5-7)8-4-9(11)14-6-8/h2-6,10,12H,1H3.
What are the key properties of 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine?
1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine has a molecular weight of 227.72 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-3-yl)-1-(furan-3-yl)-N-methylmethanamine is sourced from PubChem (CID 130905664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).