N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide

C22H23NO2 — CID 42940515

IUPACN-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide
SMILESO=C(NCC1CC2c3ccccc3C1c1ccccc12)C1CCCO1
InChIInChI=1S/C22H23NO2/c24-22(20-10-5-11-25-20)23-13-14-12-19-15-6-1-3-8-17(15)21(14)18-9-4-2-7-16(18)19/h1-4,6-9,14,19-21H,5,10-13H2,(H,23,24)
InChIKeyAOSHSCLBZSCVRK-UHFFFAOYSA-N
MW333.43 g/mol
LogP3.58
Rot. Bonds3

About N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide

N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide (PubChem CID 42940515) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide
PubChem CID42940515
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide
SMILESO=C(NCC1CC2c3ccccc3C1c1ccccc12)C1CCCO1
InChIInChI=1S/C22H23NO2/c24-22(20-10-5-11-25-20)23-13-14-12-19-15-6-1-3-8-17(15)21(14)18-9-4-2-7-16(18)19/h1-4,6-9,14,19-21H,5,10-13H2,(H,23,24)
InChIKeyAOSHSCLBZSCVRK-UHFFFAOYSA-N
XLogP3.58
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-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 N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide?
The IUPAC name of N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide (CID 42940515) is N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide?
The canonical SMILES for N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide is O=C(NCC1CC2c3ccccc3C1c1ccccc12)C1CCCO1.
What is the InChIKey of N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide?
The InChIKey is AOSHSCLBZSCVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c24-22(20-10-5-11-25-20)23-13-14-12-19-15-6-1-3-8-17(15)21(14)18-9-4-2-7-16(18)19/h1-4,6-9,14,19-21H,5,10-13H2,(H,23,24).
What are the key properties of N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide?
N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide has a molecular weight of 333.43 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 42940515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).