CID 110211756

C23H24ClN3O3 — CID 110211756

IUPAC—
SMILESO=C1NC2(COC3(CCN(C(=O)Cc4ccccc4Cl)CC3)C2)Nc2ccccc21
InChIInChI=1S/C23H24ClN3O3/c24-18-7-3-1-5-16(18)13-20(28)27-11-9-22(10-12-27)14-23(15-30-22)25-19-8-4-2-6-17(19)21(29)26-23/h1-8,25H,9-15H2,(H,26,29)
InChIKeyZIHQBNVQPIZMJZ-UHFFFAOYSA-N
MW425.92 g/mol
LogP3.22
Rot. Bonds2

About CID 110211756

CID 110211756 (PubChem CID 110211756) has the molecular formula C23H24ClN3O3 and a molecular weight of 425.92 g/mol.

Molecular Properties

Compound NameCID 110211756
PubChem CID110211756
Molecular FormulaC23H24ClN3O3
Molecular Weight425.92 g/mol
Exact Mass425.15
IUPAC Name—
SMILESO=C1NC2(COC3(CCN(C(=O)Cc4ccccc4Cl)CC3)C2)Nc2ccccc21
InChIInChI=1S/C23H24ClN3O3/c24-18-7-3-1-5-16(18)13-20(28)27-11-9-22(10-12-27)14-23(15-30-22)25-19-8-4-2-6-17(19)21(29)26-23/h1-8,25H,9-15H2,(H,26,29)
InChIKeyZIHQBNVQPIZMJZ-UHFFFAOYSA-N
XLogP3.22
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.92
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 110211750
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CID 95792549
CID 110211760
CID 110211760
CID 110211837
CID 110211837
CID 110211761
CID 110211761
CID 110211858
CID 110211858
CID 110211848
CID 110211848
methyl 3-oxo-3-(4-oxospiro[1,3-dihydroquinazoline-2,4'-piperidine]-1'-yl)propanoate
CID 134069534
CID 110211869
CID 110211869
6-chloro-1'-(2-phenylacetyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one
CID 42875396
8-[2-(2-chlorophenyl)acetyl]-3-[(2-chlorophenyl)methyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 83278758

Frequently Asked Questions

What is the IUPAC name of CID 110211756?
The IUPAC name of CID 110211756 (CID 110211756) is not available.
What is the SMILES notation for CID 110211756?
The canonical SMILES for CID 110211756 is O=C1NC2(COC3(CCN(C(=O)Cc4ccccc4Cl)CC3)C2)Nc2ccccc21.
What is the InChIKey of CID 110211756?
The InChIKey is ZIHQBNVQPIZMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN3O3/c24-18-7-3-1-5-16(18)13-20(28)27-11-9-22(10-12-27)14-23(15-30-22)25-19-8-4-2-6-17(19)21(29)26-23/h1-8,25H,9-15H2,(H,26,29).
What are the key properties of CID 110211756?
CID 110211756 has a molecular weight of 425.92 g/mol, XLogP of 3.22, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 110211756 is sourced from PubChem (CID 110211756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).