5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide

C10H10ClN3O3S — CID 106086601

IUPAC5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide
SMILESNCc1ccc(S(=O)(=O)Nc2ncccc2Cl)o1
InChIInChI=1S/C10H10ClN3O3S/c11-8-2-1-5-13-10(8)14-18(15,16)9-4-3-7(6-12)17-9/h1-5H,6,12H2,(H,13,14)
InChIKeyZAFQPVMQXWKYHZ-UHFFFAOYSA-N
MW287.73 g/mol
LogP1.59
Rot. Bonds4

About 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide

5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide (PubChem CID 106086601) has the molecular formula C10H10ClN3O3S and a molecular weight of 287.73 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide
PubChem CID106086601
Molecular FormulaC10H10ClN3O3S
Molecular Weight287.73 g/mol
Exact Mass287.01
IUPAC Name5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide
SMILESNCc1ccc(S(=O)(=O)Nc2ncccc2Cl)o1
InChIInChI=1S/C10H10ClN3O3S/c11-8-2-1-5-13-10(8)14-18(15,16)9-4-3-7(6-12)17-9/h1-5H,6,12H2,(H,13,14)
InChIKeyZAFQPVMQXWKYHZ-UHFFFAOYSA-N
XLogP1.59
TPSA98.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.73
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide (CID 106086601) is 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide is NCc1ccc(S(=O)(=O)Nc2ncccc2Cl)o1.
What is the InChIKey of 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide?
The InChIKey is ZAFQPVMQXWKYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O3S/c11-8-2-1-5-13-10(8)14-18(15,16)9-4-3-7(6-12)17-9/h1-5H,6,12H2,(H,13,14).
What are the key properties of 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide?
5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide has a molecular weight of 287.73 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(3-chloro-2-pyridinyl)furan-2-sulfonamide is sourced from PubChem (CID 106086601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).