5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide

C10H12N4O2S2 — CID 106088719

IUPAC5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)Nc2cncnc2)sc1CN
InChIInChI=1S/C10H12N4O2S2/c1-7-2-10(17-9(7)3-11)18(15,16)14-8-4-12-6-13-5-8/h2,4-6,14H,3,11H2,1H3
InChIKeyAMIOIRCIMALCJV-UHFFFAOYSA-N
MW284.37 g/mol
LogP1.11
Rot. Bonds4

About 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide

5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide (PubChem CID 106088719) has the molecular formula C10H12N4O2S2 and a molecular weight of 284.37 g/mol. Its IUPAC name is 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide
PubChem CID106088719
Molecular FormulaC10H12N4O2S2
Molecular Weight284.37 g/mol
Exact Mass284.04
IUPAC Name5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)Nc2cncnc2)sc1CN
InChIInChI=1S/C10H12N4O2S2/c1-7-2-10(17-9(7)3-11)18(15,16)14-8-4-12-6-13-5-8/h2,4-6,14H,3,11H2,1H3
InChIKeyAMIOIRCIMALCJV-UHFFFAOYSA-N
XLogP1.11
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(aminomethyl)-N-(3,4-dichlorophenyl)-4-methylthiophene-2-sulfonamide
CID 106059520
5-(aminomethyl)-N-(4-bromophenyl)-4-methylthiophene-2-sulfonamide
CID 106061445
5-(aminomethyl)-N-(6-methoxy-3-pyridinyl)-4-methylthiophene-2-sulfonamide
CID 106059973
5-(aminomethyl)-4-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)thiophene-2-sulfonamide
CID 106082868
5-(aminomethyl)-N-(5-bromo-4-methyl-2-pyridinyl)-4-methylthiophene-2-sulfonamide
CID 106070845
5-(aminomethyl)-N-(5-bromo-3-methyl-2-pyridinyl)-4-methylthiophene-2-sulfonamide
CID 106076817
5-(aminomethyl)-2-methyl-N-pyrimidin-5-ylthiophene-3-sulfonamide
CID 106088723
5-(aminomethyl)-4-methyl-N-(2,4,5-trichlorophenyl)thiophene-2-sulfonamide
CID 106057731
5-(aminomethyl)-N-(4-bromo-3-methoxyphenyl)-4-methylthiophene-2-sulfonamide
CID 106076647
5-(ethylaminomethyl)-4-methyl-N-(5-methyl-3-pyridinyl)thiophene-2-sulfonamide
CID 106087972
5-(aminomethyl)-4-methyl-N-pentan-3-ylthiophene-2-sulfonamide
CID 114138862
5-(aminomethyl)-N-(1-methoxypropan-2-yl)-4-methylthiophene-2-sulfonamide
CID 114141055

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide (CID 106088719) is 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide is Cc1cc(S(=O)(=O)Nc2cncnc2)sc1CN.
What is the InChIKey of 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide?
The InChIKey is AMIOIRCIMALCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2S2/c1-7-2-10(17-9(7)3-11)18(15,16)14-8-4-12-6-13-5-8/h2,4-6,14H,3,11H2,1H3.
What are the key properties of 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide?
5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide has a molecular weight of 284.37 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-4-methyl-N-pyrimidin-5-ylthiophene-2-sulfonamide is sourced from PubChem (CID 106088719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).