N-(5-hydroxyphosphanyloxypentyl)carbamate

C6H13NO4P- — CID 162069255

IUPACN-(5-hydroxyphosphanyloxypentyl)carbamate
SMILESO=C([O-])NCCCCCOPO
InChIInChI=1S/C6H14NO4P/c8-6(9)7-4-2-1-3-5-11-12-10/h7,10,12H,1-5H2,(H,8,9)/p-1
InChIKeyZAVYGZNPXKNOGI-UHFFFAOYSA-M
MW194.15 g/mol
LogP-0.39
Rot. Bonds7

About N-(5-hydroxyphosphanyloxypentyl)carbamate

N-(5-hydroxyphosphanyloxypentyl)carbamate (PubChem CID 162069255) has the molecular formula C6H13NO4P- and a molecular weight of 194.15 g/mol. Its IUPAC name is N-(5-hydroxyphosphanyloxypentyl)carbamate.

Molecular Properties

Compound NameN-(5-hydroxyphosphanyloxypentyl)carbamate
PubChem CID162069255
Molecular FormulaC6H13NO4P-
Molecular Weight194.15 g/mol
Exact Mass194.06
IUPAC NameN-(5-hydroxyphosphanyloxypentyl)carbamate
SMILESO=C([O-])NCCCCCOPO
InChIInChI=1S/C6H14NO4P/c8-6(9)7-4-2-1-3-5-11-12-10/h7,10,12H,1-5H2,(H,8,9)/p-1
InChIKeyZAVYGZNPXKNOGI-UHFFFAOYSA-M
XLogP-0.39
TPSA81.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.15
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-(methylamino)hexoxyphosphinous acid
CID 118527246
sodium N-dodecylcarbamate
CID 141389395
N-(4-azaniumylbutyl)carbamate
CID 119096052
N-(6-aminohexyl)carbamate;hexane-1,6-diamine;hydron;molecular hydrogen
CID 161491440
N-(4-oxobutyl)carbamate
CID 18436941
N-(3-trimethoxysilylpropyl)carbamate
CID 19019611
methyl N-[10-(methoxycarbonylamino)decyl]carbamate
CID 54285968
undecyl N-octylcarbamate
CID 168918698
N-[(4S)-4-amino-4-carboxybutyl]carbamate
CID 153456088
5-acetyloxypentylcarbamic acid
CID 151401165
37-(octadecylcarbamoyloxy)heptatriacontyl N-octadecylcarbamate
CID 156779925
hexyl N-tetradecylcarbamate
CID 91739120

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxyphosphanyloxypentyl)carbamate?
The IUPAC name of N-(5-hydroxyphosphanyloxypentyl)carbamate (CID 162069255) is N-(5-hydroxyphosphanyloxypentyl)carbamate.
What is the SMILES notation for N-(5-hydroxyphosphanyloxypentyl)carbamate?
The canonical SMILES for N-(5-hydroxyphosphanyloxypentyl)carbamate is O=C([O-])NCCCCCOPO.
What is the InChIKey of N-(5-hydroxyphosphanyloxypentyl)carbamate?
The InChIKey is ZAVYGZNPXKNOGI-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H14NO4P/c8-6(9)7-4-2-1-3-5-11-12-10/h7,10,12H,1-5H2,(H,8,9)/p-1.
What are the key properties of N-(5-hydroxyphosphanyloxypentyl)carbamate?
N-(5-hydroxyphosphanyloxypentyl)carbamate has a molecular weight of 194.15 g/mol, XLogP of -0.39, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxyphosphanyloxypentyl)carbamate is sourced from PubChem (CID 162069255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).