1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene

C24H20N2O3 — CID 13162246

IUPAC1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene
SMILESc1ccc(COc2ccc3nc4n(c3c2)CC2COC4(c3ccccc3)O2)cc1
InChIInChI=1S/C24H20N2O3/c1-3-7-17(8-4-1)15-27-19-11-12-21-22(13-19)26-14-20-16-28-24(29-20,23(26)25-21)18-9-5-2-6-10-18/h1-13,20H,14-16H2
InChIKeyAHYAUNJMQSMEKF-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.25
Rot. Bonds4

About 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene

1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene (PubChem CID 13162246) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene.

Molecular Properties

Compound Name1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene
PubChem CID13162246
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene
SMILESc1ccc(COc2ccc3nc4n(c3c2)CC2COC4(c3ccccc3)O2)cc1
InChIInChI=1S/C24H20N2O3/c1-3-7-17(8-4-1)15-27-19-11-12-21-22(13-19)26-14-20-16-28-24(29-20,23(26)25-21)18-9-5-2-6-10-18/h1-13,20H,14-16H2
InChIKeyAHYAUNJMQSMEKF-UHFFFAOYSA-N
XLogP4.25
TPSA45.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene with MolForge

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Related Compounds

1-(3-phenylmethoxyphenyl)-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4,6,8-tetraene
CID 13162275
2-(cyclobutylmethoxy)-1-methyl-6-phenylmethoxybenzimidazole
CID 154946893
[5-(hydroxymethyl)-2,2,4,5-tetrakis(6-phenylmethoxynaphthalen-2-yl)-1,3-dioxolan-4-yl]methanol
CID 90716591
2-(2-chloro-4-phenylmethoxyphenyl)oxirane
CID 146020828
2-methyl-6-phenylmethoxyquinoline
CID 82580854
1-(2-methyl-7-phenylmethoxyquinazolin-4-yl)pyrrolidin-3-ol
CID 18452845
2-(2-oxa-6-azaspiro[3.3]heptan-6-yl)-6-phenylmethoxy-1,3-benzoxazole
CID 146454151
6-(6-phenylmethoxyquinolin-3-yl)-2-oxa-6-azaspiro[3.3]heptane
CID 89443300
(4-phenylmethoxyphenyl) hypobromite
CID 151898979
CID 101083627
CID 101083627
2-[9-(4-phenylmethoxyphenoxy)nonyl]oxirane
CID 54047202
(S)-[(2S)-oxiran-2-yl]-(4-phenylmethoxyphenyl)methanol
CID 11172882

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene?
The IUPAC name of 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene (CID 13162246) is 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene.
What is the SMILES notation for 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene?
The canonical SMILES for 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene is c1ccc(COc2ccc3nc4n(c3c2)CC2COC4(c3ccccc3)O2)cc1.
What is the InChIKey of 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene?
The InChIKey is AHYAUNJMQSMEKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c1-3-7-17(8-4-1)15-27-19-11-12-21-22(13-19)26-14-20-16-28-24(29-20,23(26)25-21)18-9-5-2-6-10-18/h1-13,20H,14-16H2.
What are the key properties of 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene?
1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene has a molecular weight of 384.44 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-7-phenylmethoxy-14,15-dioxa-3,10-diazatetracyclo[10.2.1.02,10.04,9]pentadeca-2,4(9),5,7-tetraene is sourced from PubChem (CID 13162246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).