2-N-dimethylphosphanylbenzene-1,2-diamine;ethane

C10H19N2P — CID 143333934

IUPAC2-N-dimethylphosphanylbenzene-1,2-diamine;ethane
SMILESCC.CP(C)Nc1ccccc1N
InChIInChI=1S/C8H13N2P.C2H6/c1-11(2)10-8-6-4-3-5-7(8)9;1-2/h3-6,10H,9H2,1-2H3;1-2H3
InChIKeyVIGUTMXYXJCCAA-UHFFFAOYSA-N
MW198.25 g/mol
LogP3.36
Rot. Bonds2

About 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane

2-N-dimethylphosphanylbenzene-1,2-diamine;ethane (PubChem CID 143333934) has the molecular formula C10H19N2P and a molecular weight of 198.25 g/mol. Its IUPAC name is 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane.

Molecular Properties

Compound Name2-N-dimethylphosphanylbenzene-1,2-diamine;ethane
PubChem CID143333934
Molecular FormulaC10H19N2P
Molecular Weight198.25 g/mol
Exact Mass198.13
IUPAC Name2-N-dimethylphosphanylbenzene-1,2-diamine;ethane
SMILESCC.CP(C)Nc1ccccc1N
InChIInChI=1S/C8H13N2P.C2H6/c1-11(2)10-8-6-4-3-5-7(8)9;1-2/h3-6,10H,9H2,1-2H3;1-2H3
InChIKeyVIGUTMXYXJCCAA-UHFFFAOYSA-N
XLogP3.36
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.25
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;2-N-methylbenzene-1,2-diamine
CID 91146948
ethane;2-hydrazinylaniline;molecular hydrogen
CID 142165021
2-N-sulfidobenzene-1,2-diamine
CID 171097854
ethane;2-N-propylbenzene-1,2-diamine
CID 91196578
N-(2-aminophenyl)-1-phosphanylformamide;ethane
CID 90955856
2-N-tert-butylbenzene-1,2-diamine;hydrochloride
CID 91654382
methane;2-N-phosphanylbenzene-1,2-diamine
CID 143707966
2-N-iodobenzene-1,2-diamine;sulfane
CID 175939526
benzene-1,2-diamine;N-methylmethanamine
CID 174458514
ethane;methanamine;2-methylaniline
CID 91356397
2-N-[2-[cyclopropyl(methyl)amino]ethyl]benzene-1,2-diamine
CID 62975524
bis(2-N-methylbenzene-1,2-diamine);sulfuric acid
CID 157216525

Frequently Asked Questions

What is the IUPAC name of 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane?
The IUPAC name of 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane (CID 143333934) is 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane.
What is the SMILES notation for 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane?
The canonical SMILES for 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane is CC.CP(C)Nc1ccccc1N.
What is the InChIKey of 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane?
The InChIKey is VIGUTMXYXJCCAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N2P.C2H6/c1-11(2)10-8-6-4-3-5-7(8)9;1-2/h3-6,10H,9H2,1-2H3;1-2H3.
What are the key properties of 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane?
2-N-dimethylphosphanylbenzene-1,2-diamine;ethane has a molecular weight of 198.25 g/mol, XLogP of 3.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-dimethylphosphanylbenzene-1,2-diamine;ethane is sourced from PubChem (CID 143333934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).