N-(4-aminophenyl)-N-(N-phenylanilino)formamide

C19H17N3O — CID 19353740

IUPACN-(4-aminophenyl)-N-(N-phenylanilino)formamide
SMILESNc1ccc(N(C=O)N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H17N3O/c20-16-11-13-17(14-12-16)21(15-23)22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H,20H2
InChIKeyGGCFWGFJEKROFQ-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.98
Rot. Bonds5

About N-(4-aminophenyl)-N-(N-phenylanilino)formamide

N-(4-aminophenyl)-N-(N-phenylanilino)formamide (PubChem CID 19353740) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is N-(4-aminophenyl)-N-(N-phenylanilino)formamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-N-(N-phenylanilino)formamide
PubChem CID19353740
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC NameN-(4-aminophenyl)-N-(N-phenylanilino)formamide
SMILESNc1ccc(N(C=O)N(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C19H17N3O/c20-16-11-13-17(14-12-16)21(15-23)22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H,20H2
InChIKeyGGCFWGFJEKROFQ-UHFFFAOYSA-N
XLogP3.98
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

benzene-1,4-diamine;4-N,4-N-diphenylbenzene-1,4-diamine
CID 67959062
4-[N-(diethylamino)anilino]aniline
CID 174589778
N-[2-(4-aminophenyl)propan-2-yl]-N-phenylformamide
CID 58757780
N-(3-aminophenyl)-N-(4-aminophenyl)formamide
CID 174804082
4-N-phenyl-4-N-[4-[4-(N-phenylanilino)phenyl]phenyl]benzene-1,4-diamine
CID 18421146
4-[4-(N-[4-[4-(N-[4-(4-aminophenyl)phenyl]anilino)phenyl]phenyl]anilino)phenyl]aniline
CID 22944349
N-(4-aminophenyl)-N-methylformamide
CID 19983561
(N-(4-aminophenyl)anilino)azaniumylideneazanide
CID 23316008
4-(4-aminophenyl)aniline;N,N-diphenylaniline
CID 67789837
4-[4-(N-methylanilino)phenyl]aniline
CID 21015508
4-[4-(N-[4-(4-aminophenyl)phenyl]-4-phenylanilino)phenyl]aniline
CID 139760283
CID 158400952
CID 158400952

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-N-(N-phenylanilino)formamide?
The IUPAC name of N-(4-aminophenyl)-N-(N-phenylanilino)formamide (CID 19353740) is N-(4-aminophenyl)-N-(N-phenylanilino)formamide.
What is the SMILES notation for N-(4-aminophenyl)-N-(N-phenylanilino)formamide?
The canonical SMILES for N-(4-aminophenyl)-N-(N-phenylanilino)formamide is Nc1ccc(N(C=O)N(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-(4-aminophenyl)-N-(N-phenylanilino)formamide?
The InChIKey is GGCFWGFJEKROFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c20-16-11-13-17(14-12-16)21(15-23)22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H,20H2.
What are the key properties of N-(4-aminophenyl)-N-(N-phenylanilino)formamide?
N-(4-aminophenyl)-N-(N-phenylanilino)formamide has a molecular weight of 303.37 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-N-(N-phenylanilino)formamide is sourced from PubChem (CID 19353740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).