1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide

C15H24N5O4P — CID 50908761

IUPAC1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide
SMILESO=C(Nc1ccccc1)P(=O)(NN1CCOCC1)NN1CCOCC1
InChIInChI=1S/C15H24N5O4P/c21-15(16-14-4-2-1-3-5-14)25(22,17-19-6-10-23-11-7-19)18-20-8-12-24-13-9-20/h1-5H,6-13H2,(H,16,21)(H2,17,18,22)
InChIKeyCORFAZVEBDQSKP-UHFFFAOYSA-N
MW369.36 g/mol
LogP1.09
Rot. Bonds6

About 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide

1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide (PubChem CID 50908761) has the molecular formula C15H24N5O4P and a molecular weight of 369.36 g/mol. Its IUPAC name is 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide.

Molecular Properties

Compound Name1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide
PubChem CID50908761
Molecular FormulaC15H24N5O4P
Molecular Weight369.36 g/mol
Exact Mass369.16
IUPAC Name1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide
SMILESO=C(Nc1ccccc1)P(=O)(NN1CCOCC1)NN1CCOCC1
InChIInChI=1S/C15H24N5O4P/c21-15(16-14-4-2-1-3-5-14)25(22,17-19-6-10-23-11-7-19)18-20-8-12-24-13-9-20/h1-5H,6-13H2,(H,16,21)(H2,17,18,22)
InChIKeyCORFAZVEBDQSKP-UHFFFAOYSA-N
XLogP1.09
TPSA95.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.36
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide?
The IUPAC name of 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide (CID 50908761) is 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide.
What is the SMILES notation for 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide?
The canonical SMILES for 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide is O=C(Nc1ccccc1)P(=O)(NN1CCOCC1)NN1CCOCC1.
What is the InChIKey of 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide?
The InChIKey is CORFAZVEBDQSKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N5O4P/c21-15(16-14-4-2-1-3-5-14)25(22,17-19-6-10-23-11-7-19)18-20-8-12-24-13-9-20/h1-5H,6-13H2,(H,16,21)(H2,17,18,22).
What are the key properties of 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide?
1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide has a molecular weight of 369.36 g/mol, XLogP of 1.09, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide is sourced from PubChem (CID 50908761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).