N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide

C14H24N2O3S2 — CID 71918609

IUPACN-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)N(CCN(C)C)C1CCCC1
InChIInChI=1S/C14H24N2O3S2/c1-15(2)9-10-16(12-6-4-5-7-12)21(17,18)14-13(19-3)8-11-20-14/h8,11-12H,4-7,9-10H2,1-3H3
InChIKeyVXBQGNVJGLONQB-UHFFFAOYSA-N
MW332.49 g/mol
LogP2.25
Rot. Bonds7

About N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide

N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide (PubChem CID 71918609) has the molecular formula C14H24N2O3S2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide.

Molecular Properties

Compound NameN-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide
PubChem CID71918609
Molecular FormulaC14H24N2O3S2
Molecular Weight332.49 g/mol
Exact Mass332.12
IUPAC NameN-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide
SMILESCOc1ccsc1S(=O)(=O)N(CCN(C)C)C1CCCC1
InChIInChI=1S/C14H24N2O3S2/c1-15(2)9-10-16(12-6-4-5-7-12)21(17,18)14-13(19-3)8-11-20-14/h8,11-12H,4-7,9-10H2,1-3H3
InChIKeyVXBQGNVJGLONQB-UHFFFAOYSA-N
XLogP2.25
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide?
The IUPAC name of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide (CID 71918609) is N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide.
What is the SMILES notation for N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide?
The canonical SMILES for N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide is COc1ccsc1S(=O)(=O)N(CCN(C)C)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide?
The InChIKey is VXBQGNVJGLONQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3S2/c1-15(2)9-10-16(12-6-4-5-7-12)21(17,18)14-13(19-3)8-11-20-14/h8,11-12H,4-7,9-10H2,1-3H3.
What are the key properties of N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide?
N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide has a molecular weight of 332.49 g/mol, XLogP of 2.25, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-[2-(dimethylamino)ethyl]-3-methoxythiophene-2-sulfonamide is sourced from PubChem (CID 71918609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).