(8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide

C24H23N3O2 — CID 15603322

IUPAC(8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide
SMILESCNC(=O)c1cc2c(nc(C)n2C)c2c1CC[C@@H](c1cccc3ccccc13)O2
InChIInChI=1S/C24H23N3O2/c1-14-26-22-20(27(14)3)13-19(24(28)25-2)18-11-12-21(29-23(18)22)17-10-6-8-15-7-4-5-9-16(15)17/h4-10,13,21H,11-12H2,1-3H3,(H,25,28)/t21-/m0/s1
InChIKeyHUDLYPCSQSCPJF-NRFANRHFSA-N
MW385.47 g/mol
LogP4.46
Rot. Bonds2

About (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide

(8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide (PubChem CID 15603322) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide.

Molecular Properties

Compound Name(8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide
PubChem CID15603322
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC Name(8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide
SMILESCNC(=O)c1cc2c(nc(C)n2C)c2c1CC[C@@H](c1cccc3ccccc13)O2
InChIInChI=1S/C24H23N3O2/c1-14-26-22-20(27(14)3)13-19(24(28)25-2)18-11-12-21(29-23(18)22)17-10-6-8-15-7-4-5-9-16(15)17/h4-10,13,21H,11-12H2,1-3H3,(H,25,28)/t21-/m0/s1
InChIKeyHUDLYPCSQSCPJF-NRFANRHFSA-N
XLogP4.46
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide?
The IUPAC name of (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide (CID 15603322) is (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide.
What is the SMILES notation for (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide?
The canonical SMILES for (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide is CNC(=O)c1cc2c(nc(C)n2C)c2c1CC[C@@H](c1cccc3ccccc13)O2.
What is the InChIKey of (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide?
The InChIKey is HUDLYPCSQSCPJF-NRFANRHFSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-14-26-22-20(27(14)3)13-19(24(28)25-2)18-11-12-21(29-23(18)22)17-10-6-8-15-7-4-5-9-16(15)17/h4-10,13,21H,11-12H2,1-3H3,(H,25,28)/t21-/m0/s1.
What are the key properties of (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide?
(8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide has a molecular weight of 385.47 g/mol, XLogP of 4.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-N,2,3-trimethyl-8-naphthalen-1-yl-7,8-dihydro-6H-pyrano[2,3-e]benzimidazole-5-carboxamide is sourced from PubChem (CID 15603322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).