N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide

C10H18N2O2S2 — CID 97238647

IUPACN-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide
SMILESCCC[C@H](N)CNS(=O)(=O)c1ccc(C)s1
InChIInChI=1S/C10H18N2O2S2/c1-3-4-9(11)7-12-16(13,14)10-6-5-8(2)15-10/h5-6,9,12H,3-4,7,11H2,1-2H3/t9-/m0/s1
InChIKeyBZLWLQCLRAICNE-VIFPVBQESA-N
MW262.40 g/mol
LogP1.46
Rot. Bonds6

About N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide

N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide (PubChem CID 97238647) has the molecular formula C10H18N2O2S2 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide
PubChem CID97238647
Molecular FormulaC10H18N2O2S2
Molecular Weight262.40 g/mol
Exact Mass262.08
IUPAC NameN-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide
SMILESCCC[C@H](N)CNS(=O)(=O)c1ccc(C)s1
InChIInChI=1S/C10H18N2O2S2/c1-3-4-9(11)7-12-16(13,14)10-6-5-8(2)15-10/h5-6,9,12H,3-4,7,11H2,1-2H3/t9-/m0/s1
InChIKeyBZLWLQCLRAICNE-VIFPVBQESA-N
XLogP1.46
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-2-aminopentyl]-5-methylthiophene-2-sulfonamide
CID 97238648
N-(2-aminobutyl)-5-methylthiophene-2-sulfonamide
CID 63733262
N-(2-aminopropyl)-5-methylthiophene-2-sulfonamide
CID 63732116
N-ethyl-5-methylthiophene-2-sulfonamide
CID 43212959
5-methyl-N-[2-(methylamino)propyl]thiophene-2-sulfonamide
CID 120825500
5-methyl-N-pentylthiophene-2-sulfonamide
CID 39791909
5-methyl-N-(2-phenylpropyl)thiophene-2-sulfonamide
CID 47109865
N-(2-aminopentyl)-2,5-dimethylbenzenesulfonamide
CID 115752625
3-methyl-2-[[(5-methylthiophen-2-yl)sulfonylamino]methyl]butanoic acid
CID 65221421
N-(2-hydroxy-2-phenylethyl)-5-methylthiophene-2-sulfonamide
CID 43502482
N-hex-1-yn-3-yl-5-methylthiophene-2-sulfonamide
CID 106898897
N-(2-hydroxy-2-thiophen-2-ylethyl)-5-methylthiophene-2-sulfonamide
CID 90500280

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide?
The IUPAC name of N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide (CID 97238647) is N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide?
The canonical SMILES for N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide is CCC[C@H](N)CNS(=O)(=O)c1ccc(C)s1.
What is the InChIKey of N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide?
The InChIKey is BZLWLQCLRAICNE-VIFPVBQESA-N. The full InChI is InChI=1S/C10H18N2O2S2/c1-3-4-9(11)7-12-16(13,14)10-6-5-8(2)15-10/h5-6,9,12H,3-4,7,11H2,1-2H3/t9-/m0/s1.
What are the key properties of N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide?
N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide has a molecular weight of 262.40 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-aminopentyl]-5-methylthiophene-2-sulfonamide is sourced from PubChem (CID 97238647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).