5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide

C14H24N2O2S2 — CID 16887552

IUPAC5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NCC2CCN(C(C)C)CC2)s1
InChIInChI=1S/C14H24N2O2S2/c1-11(2)16-8-6-13(7-9-16)10-15-20(17,18)14-5-4-12(3)19-14/h4-5,11,13,15H,6-10H2,1-3H3
InChIKeyRZGYWAJSZUFBPB-UHFFFAOYSA-N
MW316.49 g/mol
LogP2.46
Rot. Bonds5

About 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide

5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide (PubChem CID 16887552) has the molecular formula C14H24N2O2S2 and a molecular weight of 316.49 g/mol. Its IUPAC name is 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide
PubChem CID16887552
Molecular FormulaC14H24N2O2S2
Molecular Weight316.49 g/mol
Exact Mass316.13
IUPAC Name5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)NCC2CCN(C(C)C)CC2)s1
InChIInChI=1S/C14H24N2O2S2/c1-11(2)16-8-6-13(7-9-16)10-15-20(17,18)14-5-4-12(3)19-14/h4-5,11,13,15H,6-10H2,1-3H3
InChIKeyRZGYWAJSZUFBPB-UHFFFAOYSA-N
XLogP2.46
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.49
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide?
The IUPAC name of 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide (CID 16887552) is 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)NCC2CCN(C(C)C)CC2)s1.
What is the InChIKey of 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide?
The InChIKey is RZGYWAJSZUFBPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2S2/c1-11(2)16-8-6-13(7-9-16)10-15-20(17,18)14-5-4-12(3)19-14/h4-5,11,13,15H,6-10H2,1-3H3.
What are the key properties of 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide?
5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide has a molecular weight of 316.49 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(1-propan-2-ylpiperidin-4-yl)methyl]thiophene-2-sulfonamide is sourced from PubChem (CID 16887552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).