2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide

C10H19N5O3S — CID 63978893

IUPAC2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide
SMILESCC(C)CN(CC(N)=O)S(=O)(=O)c1c(N)ncn1C
InChIInChI=1S/C10H19N5O3S/c1-7(2)4-15(5-8(11)16)19(17,18)10-9(12)13-6-14(10)3/h6-7H,4-5,12H2,1-3H3,(H2,11,16)
InChIKeyIIXSGUDMTSJLQQ-UHFFFAOYSA-N
MW289.36 g/mol
LogP-0.87
Rot. Bonds6

About 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide

2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide (PubChem CID 63978893) has the molecular formula C10H19N5O3S and a molecular weight of 289.36 g/mol. Its IUPAC name is 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide.

Molecular Properties

Compound Name2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide
PubChem CID63978893
Molecular FormulaC10H19N5O3S
Molecular Weight289.36 g/mol
Exact Mass289.12
IUPAC Name2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide
SMILESCC(C)CN(CC(N)=O)S(=O)(=O)c1c(N)ncn1C
InChIInChI=1S/C10H19N5O3S/c1-7(2)4-15(5-8(11)16)19(17,18)10-9(12)13-6-14(10)3/h6-7H,4-5,12H2,1-3H3,(H2,11,16)
InChIKeyIIXSGUDMTSJLQQ-UHFFFAOYSA-N
XLogP-0.87
TPSA124.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 5-0.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-N-(1-hydroxypropan-2-yl)-N,3-dimethylimidazole-4-sulfonamide
CID 104551001
2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methoxyethyl)amino]-N,N-dimethylacetamide
CID 63980022
5-amino-N-(2-hydroxyethyl)-3-methyl-N-(2,2,2-trifluoroethyl)imidazole-4-sulfonamide
CID 63980416
2-[(5-amino-3-methylimidazol-4-yl)sulfonylamino]acetamide
CID 63977708
2-[(4-amino-2,6-dibromophenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 61116167
5-amino-N-(3-hydroxybutyl)-3-methylimidazole-4-sulfonamide
CID 64929209
2-[(3-amino-5-methylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 61115052
2-[(3-amino-4-bromophenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 115328962
5-amino-N-[(2S)-1-hydroxypropan-2-yl]-3-methylimidazole-4-sulfonamide
CID 107212641
2-[(5-amino-3-methylimidazol-4-yl)sulfonylamino]-N-propan-2-ylacetamide
CID 63980014
2-[(5-amino-2-methylphenyl)sulfonyl-(2-methylpropyl)amino]acetamide
CID 61115794
ethyl 2-[(3-amino-1-methylpyrazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetate
CID 61107552

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide?
The IUPAC name of 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide (CID 63978893) is 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide.
What is the SMILES notation for 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide?
The canonical SMILES for 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide is CC(C)CN(CC(N)=O)S(=O)(=O)c1c(N)ncn1C.
What is the InChIKey of 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide?
The InChIKey is IIXSGUDMTSJLQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O3S/c1-7(2)4-15(5-8(11)16)19(17,18)10-9(12)13-6-14(10)3/h6-7H,4-5,12H2,1-3H3,(H2,11,16).
What are the key properties of 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide?
2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide has a molecular weight of 289.36 g/mol, XLogP of -0.87, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-3-methylimidazol-4-yl)sulfonyl-(2-methylpropyl)amino]acetamide is sourced from PubChem (CID 63978893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).