5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide

C9H14N2O2S2 — CID 146570649

IUPAC5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide
SMILESCNC(c1ccc(S(N)(=O)=O)s1)C1CC1
InChIInChI=1S/C9H14N2O2S2/c1-11-9(6-2-3-6)7-4-5-8(14-7)15(10,12)13/h4-6,9,11H,2-3H2,1H3,(H2,10,12,13)
InChIKeyIEROWSFYDIZVCK-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.07
Rot. Bonds4

About 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide

5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide (PubChem CID 146570649) has the molecular formula C9H14N2O2S2 and a molecular weight of 246.36 g/mol. Its IUPAC name is 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide
PubChem CID146570649
Molecular FormulaC9H14N2O2S2
Molecular Weight246.36 g/mol
Exact Mass246.05
IUPAC Name5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide
SMILESCNC(c1ccc(S(N)(=O)=O)s1)C1CC1
InChIInChI=1S/C9H14N2O2S2/c1-11-9(6-2-3-6)7-4-5-8(14-7)15(10,12)13/h4-6,9,11H,2-3H2,1H3,(H2,10,12,13)
InChIKeyIEROWSFYDIZVCK-UHFFFAOYSA-N
XLogP1.07
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(S)-amino(cyclopropyl)methyl]thiophene-2-sulfonamide
CID 131173158
5-[1-(cyclopentylsulfonylamino)ethyl]thiophene-2-sulfonamide
CID 105361263
1-cyclopropyl-1-[5-(2,6-dibromo-4-methylphenyl)thiophen-2-yl]-N-methylmethanamine
CID 43288016
1-[5-(4-bromophenyl)thiophen-2-yl]-1-cyclopropyl-N-methylmethanamine
CID 43288068
5-[1-(propan-2-ylsulfonylamino)ethyl]thiophene-2-sulfonamide
CID 60862958
N-methyl-1-(5-methylthiophen-2-yl)-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 105162186
1-(4-tert-butylcyclohexyl)-1-(5-chlorothiophen-2-yl)-N-methylmethanamine
CID 55196430
5-[1-(ethylsulfonylamino)ethyl]thiophene-2-sulfonamide
CID 43134149
2-cyclopropyl-N-[(5-sulfamoylthiophen-2-yl)methyl]propanamide
CID 79506363
1-cyclopropyl-N-methyl-1-[5-(2-propan-2-ylphenyl)thiophen-2-yl]methanamine
CID 43287687
1-cyclopropyl-1-[5-(2,3-dimethylphenyl)thiophen-2-yl]-N-methylmethanamine
CID 43287604
1-cyclopropyl-N-methyl-1-(5-naphthalen-2-ylthiophen-2-yl)methanamine
CID 43287655

Frequently Asked Questions

What is the IUPAC name of 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide?
The IUPAC name of 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide (CID 146570649) is 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide is CNC(c1ccc(S(N)(=O)=O)s1)C1CC1.
What is the InChIKey of 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide?
The InChIKey is IEROWSFYDIZVCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S2/c1-11-9(6-2-3-6)7-4-5-8(14-7)15(10,12)13/h4-6,9,11H,2-3H2,1H3,(H2,10,12,13).
What are the key properties of 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide?
5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide has a molecular weight of 246.36 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[cyclopropyl(methylamino)methyl]thiophene-2-sulfonamide is sourced from PubChem (CID 146570649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).