N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide

C11H17ClN2O2S2 — CID 103100511

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)NC(C)(CN)C2CC2)sc1Cl
InChIInChI=1S/C11H17ClN2O2S2/c1-7-5-9(17-10(7)12)18(15,16)14-11(2,6-13)8-3-4-8/h5,8,14H,3-4,6,13H2,1-2H3
InChIKeyQHCPZTXRDKXOCY-UHFFFAOYSA-N
MW308.86 g/mol
LogP2.12
Rot. Bonds5

About N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide

N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide (PubChem CID 103100511) has the molecular formula C11H17ClN2O2S2 and a molecular weight of 308.86 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide
PubChem CID103100511
Molecular FormulaC11H17ClN2O2S2
Molecular Weight308.86 g/mol
Exact Mass308.04
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)NC(C)(CN)C2CC2)sc1Cl
InChIInChI=1S/C11H17ClN2O2S2/c1-7-5-9(17-10(7)12)18(15,16)14-11(2,6-13)8-3-4-8/h5,8,14H,3-4,6,13H2,1-2H3
InChIKeyQHCPZTXRDKXOCY-UHFFFAOYSA-N
XLogP2.12
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.86
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide (CID 103100511) is N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide is Cc1cc(S(=O)(=O)NC(C)(CN)C2CC2)sc1Cl.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide?
The InChIKey is QHCPZTXRDKXOCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2S2/c1-7-5-9(17-10(7)12)18(15,16)14-11(2,6-13)8-3-4-8/h5,8,14H,3-4,6,13H2,1-2H3.
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide has a molecular weight of 308.86 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-5-chloro-4-methylthiophene-2-sulfonamide is sourced from PubChem (CID 103100511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).