N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide

C11H17N3O2S — CID 64522995

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)N(CC2CC2)C2CC2)[nH]1
InChIInChI=1S/C11H17N3O2S/c1-8-12-6-11(13-8)17(15,16)14(10-4-5-10)7-9-2-3-9/h6,9-10H,2-5,7H2,1H3,(H,12,13)
InChIKeyVZLKAZOXIJOJNE-UHFFFAOYSA-N
MW255.34 g/mol
LogP1.28
Rot. Bonds5

About N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide

N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide (PubChem CID 64522995) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide
PubChem CID64522995
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)N(CC2CC2)C2CC2)[nH]1
InChIInChI=1S/C11H17N3O2S/c1-8-12-6-11(13-8)17(15,16)14(10-4-5-10)7-9-2-3-9/h6,9-10H,2-5,7H2,1H3,(H,12,13)
InChIKeyVZLKAZOXIJOJNE-UHFFFAOYSA-N
XLogP1.28
TPSA66.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide (CID 64522995) is N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide is Cc1ncc(S(=O)(=O)N(CC2CC2)C2CC2)[nH]1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide?
The InChIKey is VZLKAZOXIJOJNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-8-12-6-11(13-8)17(15,16)14(10-4-5-10)7-9-2-3-9/h6,9-10H,2-5,7H2,1H3,(H,12,13).
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide?
N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide has a molecular weight of 255.34 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 64522995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).