CID 11699325

C20H33NOP — CID 11699325

IUPAC—
SMILESCC(C)(C)[C@H]1COC([C]2[CH][CH][CH][C]2P(C(C)(C)C)C(C)(C)C)=N1
InChIInChI=1S/C20H33NOP/c1-18(2,3)16-13-22-17(21-16)14-11-10-12-15(14)23(19(4,5)6)20(7,8)9/h10-12,16H,13H2,1-9H3/t16-/m1/s1
InChIKeyPZVUMSQPMXDZRX-MRXNPFEDSA-N
MW334.46 g/mol
LogP5.64
Rot. Bonds2

About CID 11699325

CID 11699325 (PubChem CID 11699325) has the molecular formula C20H33NOP and a molecular weight of 334.46 g/mol.

Molecular Properties

Compound NameCID 11699325
PubChem CID11699325
Molecular FormulaC20H33NOP
Molecular Weight334.46 g/mol
Exact Mass334.23
IUPAC Name—
SMILESCC(C)(C)[C@H]1COC([C]2[CH][CH][CH][C]2P(C(C)(C)C)C(C)(C)C)=N1
InChIInChI=1S/C20H33NOP/c1-18(2,3)16-13-22-17(21-16)14-11-10-12-15(14)23(19(4,5)6)20(7,8)9/h10-12,16H,13H2,1-9H3/t16-/m1/s1
InChIKeyPZVUMSQPMXDZRX-MRXNPFEDSA-N
XLogP5.64
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.46
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 11699325?
The IUPAC name of CID 11699325 (CID 11699325) is not available.
What is the SMILES notation for CID 11699325?
The canonical SMILES for CID 11699325 is CC(C)(C)[C@H]1COC([C]2[CH][CH][CH][C]2P(C(C)(C)C)C(C)(C)C)=N1.
What is the InChIKey of CID 11699325?
The InChIKey is PZVUMSQPMXDZRX-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H33NOP/c1-18(2,3)16-13-22-17(21-16)14-11-10-12-15(14)23(19(4,5)6)20(7,8)9/h10-12,16H,13H2,1-9H3/t16-/m1/s1.
What are the key properties of CID 11699325?
CID 11699325 has a molecular weight of 334.46 g/mol, XLogP of 5.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11699325 is sourced from PubChem (CID 11699325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).