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

C23H25NO2 — CID 75868346

IUPACN-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide
SMILESO=C(NCC1CC2c3ccccc3C1c1ccccc12)C1CCOCC1
InChIInChI=1S/C23H25NO2/c25-23(15-9-11-26-12-10-15)24-14-16-13-21-17-5-1-3-7-19(17)22(16)20-8-4-2-6-18(20)21/h1-8,15-16,21-22H,9-14H2,(H,24,25)
InChIKeyZXWOPHFBDCZBKK-UHFFFAOYSA-N
MW347.46 g/mol
LogP3.83
Rot. Bonds3

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

N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide (PubChem CID 75868346) has the molecular formula C23H25NO2 and a molecular weight of 347.46 g/mol. Its IUPAC name is N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide.

Molecular Properties

Compound NameN-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide
PubChem CID75868346
Molecular FormulaC23H25NO2
Molecular Weight347.46 g/mol
Exact Mass347.19
IUPAC NameN-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide
SMILESO=C(NCC1CC2c3ccccc3C1c1ccccc12)C1CCOCC1
InChIInChI=1S/C23H25NO2/c25-23(15-9-11-26-12-10-15)24-14-16-13-21-17-5-1-3-7-19(17)22(16)20-8-4-2-6-18(20)21/h1-8,15-16,21-22H,9-14H2,(H,24,25)
InChIKeyZXWOPHFBDCZBKK-UHFFFAOYSA-N
XLogP3.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 53.83
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)oxane-4-carboxamide 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

(1R)-N-[[(15R)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl]methyl]cyclohex-3-ene-1-carboxamide
CID 30804929
(1R)-N-[[(15S)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl]methyl]cyclohex-3-ene-1-carboxamide
CID 30804930
N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxolane-2-carboxamide
CID 42940515
(2R,3S)-3-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxirane-2-carboxamide
CID 166429192
2-methyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)propanamide
CID 42940509
1-cyclopropyl-1-(2-hydroxyethyl)-3-[[(15S)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl]methyl]urea
CID 95570542
N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)-2-thiophen-2-ylacetamide
CID 46553517
3-cyclohexyl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)propanamide
CID 16762907
2-phenoxy-N-[[(15R)-15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl]methyl]acetamide
CID 30394821
3-methyl-5-propan-2-yl-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)-1,2-oxazole-4-carboxamide
CID 24655881
2,2-dimethyl-N-[1-oxo-1-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethylamino)propan-2-yl]propanamide
CID 42942199
2-(2-methoxyphenyl)-N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)acetamide
CID 24655876

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)oxane-4-carboxamide?
The IUPAC name of N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide (CID 75868346) is N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-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)oxane-4-carboxamide?
The canonical SMILES for N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide is O=C(NCC1CC2c3ccccc3C1c1ccccc12)C1CCOCC1.
What is the InChIKey of N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide?
The InChIKey is ZXWOPHFBDCZBKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO2/c25-23(15-9-11-26-12-10-15)24-14-16-13-21-17-5-1-3-7-19(17)22(16)20-8-4-2-6-18(20)21/h1-8,15-16,21-22H,9-14H2,(H,24,25).
What are the key properties of N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide?
N-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenylmethyl)oxane-4-carboxamide has a molecular weight of 347.46 g/mol, XLogP of 3.83, 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)oxane-4-carboxamide is sourced from PubChem (CID 75868346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).