N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine

C7H8Cl2NO2P — CID 143327025

IUPACN-[chloro-(4-chlorophenoxy)phosphoryl]methanamine
SMILESCNP(=O)(Cl)Oc1ccc(Cl)cc1
InChIInChI=1S/C7H8Cl2NO2P/c1-10-13(9,11)12-7-4-2-6(8)3-5-7/h2-5H,1H3,(H,10,11)
InChIKeyNPGWXXPZURLNPC-UHFFFAOYSA-N
MW240.03 g/mol
LogP3.29
Rot. Bonds3

About N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine

N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine (PubChem CID 143327025) has the molecular formula C7H8Cl2NO2P and a molecular weight of 240.03 g/mol. Its IUPAC name is N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine.

Molecular Properties

Compound NameN-[chloro-(4-chlorophenoxy)phosphoryl]methanamine
PubChem CID143327025
Molecular FormulaC7H8Cl2NO2P
Molecular Weight240.03 g/mol
Exact Mass238.97
IUPAC NameN-[chloro-(4-chlorophenoxy)phosphoryl]methanamine
SMILESCNP(=O)(Cl)Oc1ccc(Cl)cc1
InChIInChI=1S/C7H8Cl2NO2P/c1-10-13(9,11)12-7-4-2-6(8)3-5-7/h2-5H,1H3,(H,10,11)
InChIKeyNPGWXXPZURLNPC-UHFFFAOYSA-N
XLogP3.29
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.03
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl (2S)-2-[[chloro-(4-chlorophenoxy)phosphoryl]amino]-2-iodoacetate
CID 143327902
1-chloro-4-dichlorophosphoryloxybenzene;methane;phosphoryl trichloride;propan-2-yl (2S)-2-[[chloro-(4-chlorophenoxy)phosphoryl]amino]propanoate
CID 161104099
methyl 2-[[(4-chlorophenoxy)-methylphosphoryl]amino]-2-methylpropanoate
CID 143327879
N-[(4-chlorophenoxy)-methylphosphoryl]-4-methylaniline
CID 11860048
N-[chloro-(4-methylphenoxy)phosphoryl]-N-methylmethanamine
CID 10585736
(4-chlorophenyl) phenyl phosphate
CID 71363636
bis(4-chlorophenoxy)-methoxy-sulfanylidene-λ5-phosphane
CID 10337854
bis(4-chlorophenyl) (3-methylphenyl) phosphate
CID 6426541
N-[(4-chlorophenoxy)-methylphosphoryl]-4-propan-2-yloxyaniline
CID 11860033
N-bis(4-chlorophenoxy)phosphoryl-5-chloro-2-methoxyaniline
CID 2066688
disodium;[(4-chlorophenoxy)-hydroxyphosphoryl]formic acid;hydride
CID 173417372
N-bis(4-chlorophenoxy)phosphoryl-2,5-dimethoxyaniline
CID 2272806

Frequently Asked Questions

What is the IUPAC name of N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine?
The IUPAC name of N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine (CID 143327025) is N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine.
What is the SMILES notation for N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine?
The canonical SMILES for N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine is CNP(=O)(Cl)Oc1ccc(Cl)cc1.
What is the InChIKey of N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine?
The InChIKey is NPGWXXPZURLNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8Cl2NO2P/c1-10-13(9,11)12-7-4-2-6(8)3-5-7/h2-5H,1H3,(H,10,11).
What are the key properties of N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine?
N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine has a molecular weight of 240.03 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[chloro-(4-chlorophenoxy)phosphoryl]methanamine is sourced from PubChem (CID 143327025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).