N-(2-aminophenyl)-1-phosphanylformamide;ethane

C9H15N2OP — CID 90955856

IUPACN-(2-aminophenyl)-1-phosphanylformamide;ethane
SMILESCC.Nc1ccccc1NC(=O)P
InChIInChI=1S/C7H9N2OP.C2H6/c8-5-3-1-2-4-6(5)9-7(10)11;1-2/h1-4H,8,11H2,(H,9,10);1-2H3
InChIKeyNGZBJQDKPUXHFP-UHFFFAOYSA-N
MW198.21 g/mol
LogP2.70
Rot. Bonds1

About N-(2-aminophenyl)-1-phosphanylformamide;ethane

N-(2-aminophenyl)-1-phosphanylformamide;ethane (PubChem CID 90955856) has the molecular formula C9H15N2OP and a molecular weight of 198.21 g/mol. Its IUPAC name is N-(2-aminophenyl)-1-phosphanylformamide;ethane.

Molecular Properties

Compound NameN-(2-aminophenyl)-1-phosphanylformamide;ethane
PubChem CID90955856
Molecular FormulaC9H15N2OP
Molecular Weight198.21 g/mol
Exact Mass198.09
IUPAC NameN-(2-aminophenyl)-1-phosphanylformamide;ethane
SMILESCC.Nc1ccccc1NC(=O)P
InChIInChI=1S/C7H9N2OP.C2H6/c8-5-3-1-2-4-6(5)9-7(10)11;1-2/h1-4H,8,11H2,(H,9,10);1-2H3
InChIKeyNGZBJQDKPUXHFP-UHFFFAOYSA-N
XLogP2.70
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.21
LogP ≤ 52.70
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

N-(2-aminophenyl)-2-bromoacetamide
CID 89401895
2-[[2-(2-aminoanilino)-2-oxoethyl]amino]-N-(2-aminophenyl)acetamide
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2-(2-aminoanilino)-2-oxoethanesulfinic acid
CID 175416485
N-(2-aminophenyl)-2-methylprop-2-enamide;propane
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N-(2-aminophenyl)-4-hydroxybenzamide;ethane
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N-(2-aminophenyl)prop-2-enamide;ethane;molecular hydrogen
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N-(2-aminophenyl)-4-methoxybutanamide;hydrochloride
CID 119422032
N-(2-aminophenyl)-2-propoxyacetamide;hydrochloride
CID 119422200
N-(2-aminophenyl)-5-methoxypentanamide
CID 119422437
1-(2-aminophenyl)-3-iodourea
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2-methylpropyl N-(2-aminophenyl)carbamate
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Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-1-phosphanylformamide;ethane?
The IUPAC name of N-(2-aminophenyl)-1-phosphanylformamide;ethane (CID 90955856) is N-(2-aminophenyl)-1-phosphanylformamide;ethane.
What is the SMILES notation for N-(2-aminophenyl)-1-phosphanylformamide;ethane?
The canonical SMILES for N-(2-aminophenyl)-1-phosphanylformamide;ethane is CC.Nc1ccccc1NC(=O)P.
What is the InChIKey of N-(2-aminophenyl)-1-phosphanylformamide;ethane?
The InChIKey is NGZBJQDKPUXHFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N2OP.C2H6/c8-5-3-1-2-4-6(5)9-7(10)11;1-2/h1-4H,8,11H2,(H,9,10);1-2H3.
What are the key properties of N-(2-aminophenyl)-1-phosphanylformamide;ethane?
N-(2-aminophenyl)-1-phosphanylformamide;ethane has a molecular weight of 198.21 g/mol, XLogP of 2.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-1-phosphanylformamide;ethane is sourced from PubChem (CID 90955856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).