phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium

C15H18N2O4P2U2 — CID 59679788

IUPACphosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium
SMILESO=C(O)Nc1ccc(Cc2ccc(NC(=O)OP)cc2)cc1.P.[U].[U]
InChIInChI=1S/C15H15N2O4P.H3P.2U/c18-14(19)16-12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)17-15(20)21-22;;;/h1-8,16H,9,22H2,(H,17,20)(H,18,19);1H3;;
InChIKeyVXKMEHOWWBBXRB-UHFFFAOYSA-N
MW828.32 g/mol
LogP3.76
Rot. Bonds4

About phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium

phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium (PubChem CID 59679788) has the molecular formula C15H18N2O4P2U2 and a molecular weight of 828.32 g/mol. Its IUPAC name is phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium.

Molecular Properties

Compound Namephosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium
PubChem CID59679788
Molecular FormulaC15H18N2O4P2U2
Molecular Weight828.32 g/mol
Exact Mass828.18
IUPAC Namephosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium
SMILESO=C(O)Nc1ccc(Cc2ccc(NC(=O)OP)cc2)cc1.P.[U].[U]
InChIInChI=1S/C15H15N2O4P.H3P.2U/c18-14(19)16-12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)17-15(20)21-22;;;/h1-8,16H,9,22H2,(H,17,20)(H,18,19);1H3;;
InChIKeyVXKMEHOWWBBXRB-UHFFFAOYSA-N
XLogP3.76
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500828.32
LogP ≤ 53.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid
CID 59679789
5-(acetyloxycarbonylamino)pentylcarbamoyl-[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;phosphane;uranium
CID 59679782
prop-2-enyl N-[4-[[4-(prop-2-enoxycarbonylamino)phenyl]methyl]phenyl]carbamate
CID 3455881
(4-phenylphenyl) N-[4-[[4-[(4-phenylphenoxy)carbonylamino]phenyl]methyl]phenyl]carbamate
CID 67179519
[4-(2-oxoethyl)phenyl]carbamic acid
CID 87359539
[4-(2-iodoethyl)phenyl]carbamic acid
CID 66577892
[4-[(3-fluoro-4-formylphenyl)methyl]phenyl]carbamic acid
CID 174187468
[4-(propoxycarbonylamino)phenyl]carbamic acid
CID 70130219
[4-[[4-(pentylcarbamoylamino)phenyl]methyl]phenyl]carbamic acid
CID 69144351
2-hydroxyethyl N-[4-[(4-acetamidophenyl)methyl]phenyl]carbamate
CID 170966813
[4-(2-methylpropyl)phenyl]carbamic acid
CID 115170610
methyl N-[4-[[4-(2-methylpropanoylamino)phenyl]methyl]phenyl]carbamate;molecular hydrogen
CID 144683165

Frequently Asked Questions

What is the IUPAC name of phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium?
The IUPAC name of phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium (CID 59679788) is phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium.
What is the SMILES notation for phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium?
The canonical SMILES for phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium is O=C(O)Nc1ccc(Cc2ccc(NC(=O)OP)cc2)cc1.P.[U].[U].
What is the InChIKey of phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium?
The InChIKey is VXKMEHOWWBBXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N2O4P.H3P.2U/c18-14(19)16-12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)17-15(20)21-22;;;/h1-8,16H,9,22H2,(H,17,20)(H,18,19);1H3;;.
What are the key properties of phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium?
phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium has a molecular weight of 828.32 g/mol, XLogP of 3.76, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phosphane;[4-[[4-(phosphanyloxycarbonylamino)phenyl]methyl]phenyl]carbamic acid;uranium is sourced from PubChem (CID 59679788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).