N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide

C14H17N3O2 — CID 110869282

IUPACN-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide
SMILESCN(C(=O)C1CCCO1)c1ccc2c(c1)ncn2C
InChIInChI=1S/C14H17N3O2/c1-16-9-15-11-8-10(5-6-12(11)16)17(2)14(18)13-4-3-7-19-13/h5-6,8-9,13H,3-4,7H2,1-2H3
InChIKeyWSRWTYUPEUSNMK-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.72
Rot. Bonds2

About N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide

N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide (PubChem CID 110869282) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide
PubChem CID110869282
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide
SMILESCN(C(=O)C1CCCO1)c1ccc2c(c1)ncn2C
InChIInChI=1S/C14H17N3O2/c1-16-9-15-11-8-10(5-6-12(11)16)17(2)14(18)13-4-3-7-19-13/h5-6,8-9,13H,3-4,7H2,1-2H3
InChIKeyWSRWTYUPEUSNMK-UHFFFAOYSA-N
XLogP1.72
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide?
The IUPAC name of N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide (CID 110869282) is N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide is CN(C(=O)C1CCCO1)c1ccc2c(c1)ncn2C.
What is the InChIKey of N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide?
The InChIKey is WSRWTYUPEUSNMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-16-9-15-11-8-10(5-6-12(11)16)17(2)14(18)13-4-3-7-19-13/h5-6,8-9,13H,3-4,7H2,1-2H3.
What are the key properties of N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide?
N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.72, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide is sourced from PubChem (CID 110869282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).