1-N,4-N-bis(phosphanyl)benzene-1,4-diamine

C6H10N2P2 — CID 87247187

IUPAC1-N,4-N-bis(phosphanyl)benzene-1,4-diamine
SMILESPNc1ccc(NP)cc1
InChIInChI=1S/C6H10N2P2/c9-7-5-1-2-6(8-10)4-3-5/h1-4,7-8H,9-10H2
InChIKeyXOTIQWTXEQUOSZ-UHFFFAOYSA-N
MW172.11 g/mol
LogP2.09
Rot. Bonds2

About 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine

1-N,4-N-bis(phosphanyl)benzene-1,4-diamine (PubChem CID 87247187) has the molecular formula C6H10N2P2 and a molecular weight of 172.11 g/mol. Its IUPAC name is 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine.

Molecular Properties

Compound Name1-N,4-N-bis(phosphanyl)benzene-1,4-diamine
PubChem CID87247187
Molecular FormulaC6H10N2P2
Molecular Weight172.11 g/mol
Exact Mass172.03
IUPAC Name1-N,4-N-bis(phosphanyl)benzene-1,4-diamine
SMILESPNc1ccc(NP)cc1
InChIInChI=1S/C6H10N2P2/c9-7-5-1-2-6(8-10)4-3-5/h1-4,7-8H,9-10H2
InChIKeyXOTIQWTXEQUOSZ-UHFFFAOYSA-N
XLogP2.09
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.11
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[4-(phosphanylamino)phenyl] cyanate
CID 69032253
benzene;4-ethyl-N-phosphanylaniline
CID 175020681
3-methyl-4-[2-methyl-4-(phosphanylamino)phenyl]aniline
CID 130415083
1-N,4-N-bis(prop-1-en-2-yl)benzene-1,4-diamine
CID 134219544
3-(4-acetamidoanilino)-2-methylbut-2-enoic acid
CID 69497054
1-phenyl-2-[4-(2-phenylhydrazinyl)phenyl]hydrazine
CID 169215100
2-[(4-acetamidophenyl)sulfonylamino]propanoic acid
CID 3393223
N-(4-methylphenyl)acetamide
CID 7684
1-[4-(2-oxopropylamino)anilino]propan-2-one
CID 141317857
4-N-(4-aminophenyl)benzene-1,4-diamine
CID 10841
hydrazine;N-phenylaniline
CID 159755629
N-(4-acetamidophenyl)-2-aminopropanamide;hydrochloride
CID 119261426

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine?
The IUPAC name of 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine (CID 87247187) is 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine.
What is the SMILES notation for 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine?
The canonical SMILES for 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine is PNc1ccc(NP)cc1.
What is the InChIKey of 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine?
The InChIKey is XOTIQWTXEQUOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2P2/c9-7-5-1-2-6(8-10)4-3-5/h1-4,7-8H,9-10H2.
What are the key properties of 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine?
1-N,4-N-bis(phosphanyl)benzene-1,4-diamine has a molecular weight of 172.11 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-bis(phosphanyl)benzene-1,4-diamine is sourced from PubChem (CID 87247187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).