CID 11386099

C23H23NOP — CID 11386099

IUPAC—
SMILESO=C([C]1[CH][CH][CH][CH]1)N1CCC[C@H]1CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23NOP/c25-23(19-10-7-8-11-19)24-17-9-12-20(24)18-26(21-13-3-1-4-14-21)22-15-5-2-6-16-22/h1-8,10-11,13-16,20H,9,12,17-18H2/t20-/m0/s1
InChIKeyXBMNQYAQWDTDFU-FQEVSTJZSA-N
MW360.42 g/mol
LogP3.52
Rot. Bonds5

About CID 11386099

CID 11386099 (PubChem CID 11386099) has the molecular formula C23H23NOP and a molecular weight of 360.42 g/mol.

Molecular Properties

Compound NameCID 11386099
PubChem CID11386099
Molecular FormulaC23H23NOP
Molecular Weight360.42 g/mol
Exact Mass360.15
IUPAC Name—
SMILESO=C([C]1[CH][CH][CH][CH]1)N1CCC[C@H]1CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23NOP/c25-23(19-10-7-8-11-19)24-17-9-12-20(24)18-26(21-13-3-1-4-14-21)22-15-5-2-6-16-22/h1-8,10-11,13-16,20H,9,12,17-18H2/t20-/m0/s1
InChIKeyXBMNQYAQWDTDFU-FQEVSTJZSA-N
XLogP3.52
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1-[(2S)-2-(diphenylphosphanylmethyl)pyrrolidin-1-yl]propan-1-one
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[(2S)-2-(diphenylphosphanylmethyl)pyrrolidin-1-yl]-(2-propylsulfanylphenyl)methanone
CID 100934790
[2-(diphenylphosphanylmethyl)pyrrolidin-1-yl]-diphenylphosphane
CID 53427371
[(2S)-2-(aminomethyl)pyrrolidin-1-yl]-phenylmethanone
CID 28706917
(2-ethylpyrrolidin-1-yl)-phenylmethanone
CID 20577009
5-[(2S)-2-(diphenylphosphanylmethyl)pyrrolidin-1-yl]-N-(trifluoromethylsulfonyl)pentanamide
CID 102199811
[2-(benzenesulfonylmethyl)pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 71805873
[2-(benzenesulfonylmethyl)pyrrolidin-1-yl]-(4-phenylphenyl)methanone
CID 90585651
[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]-(4-phenylphenyl)methanone
CID 79027798
(2R)-2-amino-1-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-phenylethanone
CID 61409346
phenyl-[(2S)-2-(3,3,3-trifluoropropyl)pyrrolidin-1-yl]methanone
CID 176730294
(2-ethylpyrrolidin-1-yl)-(2-methylphenyl)methanone
CID 110604637

Frequently Asked Questions

What is the IUPAC name of CID 11386099?
The IUPAC name of CID 11386099 (CID 11386099) is not available.
What is the SMILES notation for CID 11386099?
The canonical SMILES for CID 11386099 is O=C([C]1[CH][CH][CH][CH]1)N1CCC[C@H]1CP(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 11386099?
The InChIKey is XBMNQYAQWDTDFU-FQEVSTJZSA-N. The full InChI is InChI=1S/C23H23NOP/c25-23(19-10-7-8-11-19)24-17-9-12-20(24)18-26(21-13-3-1-4-14-21)22-15-5-2-6-16-22/h1-8,10-11,13-16,20H,9,12,17-18H2/t20-/m0/s1.
What are the key properties of CID 11386099?
CID 11386099 has a molecular weight of 360.42 g/mol, XLogP of 3.52, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11386099 is sourced from PubChem (CID 11386099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).