N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide

C10H18N2O2S2 — CID 86784631

IUPACN-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)N(C)C(C)CN)sc1C
InChIInChI=1S/C10H18N2O2S2/c1-7-5-10(15-9(7)3)16(13,14)12(4)8(2)6-11/h5,8H,6,11H2,1-4H3
InChIKeyKLBPVXVVWMSQBU-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.33
Rot. Bonds4

About N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide

N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide (PubChem CID 86784631) has the molecular formula C10H18N2O2S2 and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide
PubChem CID86784631
Molecular FormulaC10H18N2O2S2
Molecular Weight262.40 g/mol
Exact Mass262.08
IUPAC NameN-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide
SMILESCc1cc(S(=O)(=O)N(C)C(C)CN)sc1C
InChIInChI=1S/C10H18N2O2S2/c1-7-5-10(15-9(7)3)16(13,14)12(4)8(2)6-11/h5,8H,6,11H2,1-4H3
InChIKeyKLBPVXVVWMSQBU-UHFFFAOYSA-N
XLogP1.33
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-5-methyl-2-thiophenesulfonamide
CID 2241003
N-[2-(dimethylamino)ethyl]-2,5-dimethylthiophene-3-sulfonamide
CID 6602863
(3R*,4S*)-1-[(5-ethyl-2-thienyl)sulfonyl]-4-propylpyrrolidin-3-amine
CID 72858030
N-(2-aminoethyl)-2,5-dimethylthiophene-3-sulfonamide hydrochloride
CID 71756742
5-methyl-N-{[1-(propan-2-yl)piperidin-4-yl]methyl}thiophene-2-sulfonamide
CID 16887552
N-[2-(Dimethylamino)ethyl]-2,5-dimethyl-3-thiophenesulfonamide
CID 717969
N-[(1-aminocyclohexyl)methyl]-2,5-dimethylthiophene-3-sulfonamide
CID 43598158
[1-(4,5-Dimethylthiophen-2-yl)sulfonylpyrrolidin-2-yl]methanamine
CID 86784654
4,5-dimethyl-N-[[(2R)-piperidin-2-yl]methyl]thiophene-2-sulfonamide
CID 99777149
4,5-dimethyl-N-[(2S)-2-methyl-3-(methylamino)propyl]thiophene-2-sulfonamide
CID 99852831
N-[(1-aminocyclobutyl)methyl]-5-methylthiophene-2-sulfonamide
CID 104438013
N-({1-[Ethyl(methyl)amino]cyclopentyl}methyl)-5-methylthiophene-2-sulfonamide
CID 122563677

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide?
The IUPAC name of N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide (CID 86784631) is N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide is Cc1cc(S(=O)(=O)N(C)C(C)CN)sc1C.
What is the InChIKey of N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide?
The InChIKey is KLBPVXVVWMSQBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S2/c1-7-5-10(15-9(7)3)16(13,14)12(4)8(2)6-11/h5,8H,6,11H2,1-4H3.
What are the key properties of N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide?
N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide has a molecular weight of 262.40 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-N,4,5-trimethylthiophene-2-sulfonamide is sourced from PubChem (CID 86784631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).