4-[bis(ethylamino)phosphorylamino]phenol

C10H18N3O2P — CID 57317861

IUPAC4-[bis(ethylamino)phosphorylamino]phenol
SMILESCCNP(=O)(NCC)Nc1ccc(O)cc1
InChIInChI=1S/C10H18N3O2P/c1-3-11-16(15,12-4-2)13-9-5-7-10(14)8-6-9/h5-8,14H,3-4H2,1-2H3,(H3,11,12,13,15)
InChIKeyUGKHMAFFDDXACP-UHFFFAOYSA-N
MW243.25 g/mol
LogP2.13
Rot. Bonds6

About 4-[bis(ethylamino)phosphorylamino]phenol

4-[bis(ethylamino)phosphorylamino]phenol (PubChem CID 57317861) has the molecular formula C10H18N3O2P and a molecular weight of 243.25 g/mol. Its IUPAC name is 4-[bis(ethylamino)phosphorylamino]phenol.

Molecular Properties

Compound Name4-[bis(ethylamino)phosphorylamino]phenol
PubChem CID57317861
Molecular FormulaC10H18N3O2P
Molecular Weight243.25 g/mol
Exact Mass243.11
IUPAC Name4-[bis(ethylamino)phosphorylamino]phenol
SMILESCCNP(=O)(NCC)Nc1ccc(O)cc1
InChIInChI=1S/C10H18N3O2P/c1-3-11-16(15,12-4-2)13-9-5-7-10(14)8-6-9/h5-8,14H,3-4H2,1-2H3,(H3,11,12,13,15)
InChIKeyUGKHMAFFDDXACP-UHFFFAOYSA-N
XLogP2.13
TPSA73.39 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.25
LogP ≤ 52.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[bis(ethylamino)phosphorylamino]phenol?
The IUPAC name of 4-[bis(ethylamino)phosphorylamino]phenol (CID 57317861) is 4-[bis(ethylamino)phosphorylamino]phenol.
What is the SMILES notation for 4-[bis(ethylamino)phosphorylamino]phenol?
The canonical SMILES for 4-[bis(ethylamino)phosphorylamino]phenol is CCNP(=O)(NCC)Nc1ccc(O)cc1.
What is the InChIKey of 4-[bis(ethylamino)phosphorylamino]phenol?
The InChIKey is UGKHMAFFDDXACP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N3O2P/c1-3-11-16(15,12-4-2)13-9-5-7-10(14)8-6-9/h5-8,14H,3-4H2,1-2H3,(H3,11,12,13,15).
What are the key properties of 4-[bis(ethylamino)phosphorylamino]phenol?
4-[bis(ethylamino)phosphorylamino]phenol has a molecular weight of 243.25 g/mol, XLogP of 2.13, 6 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[bis(ethylamino)phosphorylamino]phenol is sourced from PubChem (CID 57317861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).