1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one

C15H19N7O4S — CID 163316215

IUPAC1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one
SMILESCn1nnnc1C1CN(S(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)CCO1
InChIInChI=1S/C15H19N7O4S/c1-19-11-5-4-10(8-12(11)20(2)15(19)23)27(24,25)22-6-7-26-13(9-22)14-16-17-18-21(14)3/h4-5,8,13H,6-7,9H2,1-3H3
InChIKeyASKWUINTENMUBM-UHFFFAOYSA-N
MW393.43 g/mol
LogP-0.84
Rot. Bonds3

About 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one

1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one (PubChem CID 163316215) has the molecular formula C15H19N7O4S and a molecular weight of 393.43 g/mol. Its IUPAC name is 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one.

Molecular Properties

Compound Name1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one
PubChem CID163316215
Molecular FormulaC15H19N7O4S
Molecular Weight393.43 g/mol
Exact Mass393.12
IUPAC Name1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one
SMILESCn1nnnc1C1CN(S(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)CCO1
InChIInChI=1S/C15H19N7O4S/c1-19-11-5-4-10(8-12(11)20(2)15(19)23)27(24,25)22-6-7-26-13(9-22)14-16-17-18-21(14)3/h4-5,8,13H,6-7,9H2,1-3H3
InChIKeyASKWUINTENMUBM-UHFFFAOYSA-N
XLogP-0.84
TPSA117.14 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.43
LogP ≤ 5-0.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-5-(2-phenylmorpholin-4-yl)sulfonyl-1,3-benzoxazol-2-one
CID 71806101
5-(3-aminopiperidin-1-yl)sulfonyl-1,3-dimethylbenzimidazol-2-one
CID 119959710
3-methyl-6-(2-methylmorpholin-4-yl)sulfonyl-1,3-benzoxazol-2-one
CID 110292469
2-(4-methylphenyl)-4-(4-methylphenyl)sulfonylmorpholine
CID 110326567
1,3-dimethyl-5-(4-piperidin-4-ylpiperidin-1-yl)sulfonylbenzimidazol-2-one
CID 146041276
1,3-dimethyl-5-[[(5S)-2-oxa-9-azaspiro[4.5]decan-9-yl]sulfonyl]benzimidazol-2-one
CID 97208631
5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]sulfonyl-1,3-dimethylbenzimidazol-2-one
CID 172895773
4-methyl-2-[(2S)-4-(4-methylphenyl)sulfonylmorpholin-2-yl]-1H-pyrimidin-6-one
CID 137166559
(2R)-2-(4,6-dimethylpyrimidin-2-yl)-4-(4-methylphenyl)sulfonylmorpholine
CID 124999153
N-[1-(1,3-dimethyl-2-oxobenzimidazol-5-yl)sulfonylpiperidin-4-yl]-N-methylacetamide
CID 49456349
1,3-dimethyl-5-[4-(2-methylpropanoyl)piperazin-1-yl]sulfonylbenzimidazol-2-one
CID 19259561
4-(3,4-dimethylphenyl)sulfonyl-2-(4-methoxyphenyl)morpholine
CID 110327242

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one?
The IUPAC name of 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one (CID 163316215) is 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one.
What is the SMILES notation for 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one?
The canonical SMILES for 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one is Cn1nnnc1C1CN(S(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)CCO1.
What is the InChIKey of 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one?
The InChIKey is ASKWUINTENMUBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N7O4S/c1-19-11-5-4-10(8-12(11)20(2)15(19)23)27(24,25)22-6-7-26-13(9-22)14-16-17-18-21(14)3/h4-5,8,13H,6-7,9H2,1-3H3.
What are the key properties of 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one?
1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one has a molecular weight of 393.43 g/mol, XLogP of -0.84, 3 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-[2-(1-methyltetrazol-5-yl)morpholin-4-yl]sulfonylbenzimidazol-2-one is sourced from PubChem (CID 163316215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).