CID 134974290

C23H27NO2 — CID 134974290

IUPAC—
SMILES[CH]C1CN(Cc2ccccc2)C(c2ccccc2)C1C(=O)OC(C)(C)C
InChIInChI=1S/C23H27NO2/c1-17-15-24(16-18-11-7-5-8-12-18)21(19-13-9-6-10-14-19)20(17)22(25)26-23(2,3)4/h1,5-14,17,20-21H,15-16H2,2-4H3
InChIKeyZDSOOCLCKSLJBF-UHFFFAOYSA-N
MW349.47 g/mol
LogP4.53
Rot. Bonds4

About CID 134974290

CID 134974290 (PubChem CID 134974290) has the molecular formula C23H27NO2 and a molecular weight of 349.47 g/mol.

Molecular Properties

Compound NameCID 134974290
PubChem CID134974290
Molecular FormulaC23H27NO2
Molecular Weight349.47 g/mol
Exact Mass349.20
IUPAC Name—
SMILES[CH]C1CN(Cc2ccccc2)C(c2ccccc2)C1C(=O)OC(C)(C)C
InChIInChI=1S/C23H27NO2/c1-17-15-24(16-18-11-7-5-8-12-18)21(19-13-9-6-10-14-19)20(17)22(25)26-23(2,3)4/h1,5-14,17,20-21H,15-16H2,2-4H3
InChIKeyZDSOOCLCKSLJBF-UHFFFAOYSA-N
XLogP4.53
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.47
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 134974290?
The IUPAC name of CID 134974290 (CID 134974290) is not available.
What is the SMILES notation for CID 134974290?
The canonical SMILES for CID 134974290 is [CH]C1CN(Cc2ccccc2)C(c2ccccc2)C1C(=O)OC(C)(C)C.
What is the InChIKey of CID 134974290?
The InChIKey is ZDSOOCLCKSLJBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27NO2/c1-17-15-24(16-18-11-7-5-8-12-18)21(19-13-9-6-10-14-19)20(17)22(25)26-23(2,3)4/h1,5-14,17,20-21H,15-16H2,2-4H3.
What are the key properties of CID 134974290?
CID 134974290 has a molecular weight of 349.47 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134974290 is sourced from PubChem (CID 134974290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).