ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide

C14H24N2O3S — CID 143631455

IUPACethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide
SMILESCC.CC.CN(Cc1nccc2occc12)S(C)(=O)=O
InChIInChI=1S/C10H12N2O3S.2C2H6/c1-12(16(2,13)14)7-9-8-4-6-15-10(8)3-5-11-9;2*1-2/h3-6H,7H2,1-2H3;2*1-2H3
InChIKeySZXIFLWKKNHKNP-UHFFFAOYSA-N
MW300.42 g/mol
LogP3.27
Rot. Bonds3

About ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide

ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide (PubChem CID 143631455) has the molecular formula C14H24N2O3S and a molecular weight of 300.42 g/mol. Its IUPAC name is ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide.

Molecular Properties

Compound Nameethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide
PubChem CID143631455
Molecular FormulaC14H24N2O3S
Molecular Weight300.42 g/mol
Exact Mass300.15
IUPAC Nameethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide
SMILESCC.CC.CN(Cc1nccc2occc12)S(C)(=O)=O
InChIInChI=1S/C10H12N2O3S.2C2H6/c1-12(16(2,13)14)7-9-8-4-6-15-10(8)3-5-11-9;2*1-2/h3-6H,7H2,1-2H3;2*1-2H3
InChIKeySZXIFLWKKNHKNP-UHFFFAOYSA-N
XLogP3.27
TPSA63.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide?
The IUPAC name of ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide (CID 143631455) is ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide.
What is the SMILES notation for ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide?
The canonical SMILES for ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide is CC.CC.CN(Cc1nccc2occc12)S(C)(=O)=O.
What is the InChIKey of ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide?
The InChIKey is SZXIFLWKKNHKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3S.2C2H6/c1-12(16(2,13)14)7-9-8-4-6-15-10(8)3-5-11-9;2*1-2/h3-6H,7H2,1-2H3;2*1-2H3.
What are the key properties of ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide?
ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide has a molecular weight of 300.42 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(furo[3,2-c]pyridin-4-ylmethyl)-N-methylmethanesulfonamide is sourced from PubChem (CID 143631455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).