2-[bis(2-aminophenyl)-phenylmethyl]aniline

C25H23N3 — CID 18354124

IUPAC2-[bis(2-aminophenyl)-phenylmethyl]aniline
SMILESNc1ccccc1C(c1ccccc1)(c1ccccc1N)c1ccccc1N
InChIInChI=1S/C25H23N3/c26-22-15-7-4-12-19(22)25(18-10-2-1-3-11-18,20-13-5-8-16-23(20)27)21-14-6-9-17-24(21)28/h1-17H,26-28H2
InChIKeyWTQLBZPEIFKUQJ-UHFFFAOYSA-N
MW365.48 g/mol
LogP4.82
Rot. Bonds4

About 2-[bis(2-aminophenyl)-phenylmethyl]aniline

2-[bis(2-aminophenyl)-phenylmethyl]aniline (PubChem CID 18354124) has the molecular formula C25H23N3 and a molecular weight of 365.48 g/mol. Its IUPAC name is 2-[bis(2-aminophenyl)-phenylmethyl]aniline.

Molecular Properties

Compound Name2-[bis(2-aminophenyl)-phenylmethyl]aniline
PubChem CID18354124
Molecular FormulaC25H23N3
Molecular Weight365.48 g/mol
Exact Mass365.19
IUPAC Name2-[bis(2-aminophenyl)-phenylmethyl]aniline
SMILESNc1ccccc1C(c1ccccc1)(c1ccccc1N)c1ccccc1N
InChIInChI=1S/C25H23N3/c26-22-15-7-4-12-19(22)25(18-10-2-1-3-11-18,20-13-5-8-16-23(20)27)21-14-6-9-17-24(21)28/h1-17H,26-28H2
InChIKeyWTQLBZPEIFKUQJ-UHFFFAOYSA-N
XLogP4.82
TPSA78.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 54.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-(2-aminophenyl)-1-phenylethanol
CID 92860842
3-[diamino(phenyl)methyl]benzene-1,2-diamine
CID 54107045
2-tert-butylaniline
CID 159041627
2-[2-[4-[2-(2-aminophenyl)propan-2-yl]phenyl]propan-2-yl]aniline
CID 18997970
(2-aminophenyl)-nitro-phenylmethanol
CID 163711864
1-(2-aminophenyl)-4,4-dimethyl-1-phenylpent-2-yn-1-ol
CID 23624782
2-[difluoro(iodo)methyl]aniline
CID 167085187
CID 175980360
CID 175980360
2-(1,1-dibromo-2-phenylethyl)aniline
CID 162350796
2-chloro-4-tritylaniline
CID 3502862
2-[2-(2-phenylpropan-2-yl)phenoxy]aniline
CID 67055511
2-[[2-amino-5-(trifluoromethyl)phenyl]-diphenylmethyl]-4-methylaniline
CID 159263001

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-aminophenyl)-phenylmethyl]aniline?
The IUPAC name of 2-[bis(2-aminophenyl)-phenylmethyl]aniline (CID 18354124) is 2-[bis(2-aminophenyl)-phenylmethyl]aniline.
What is the SMILES notation for 2-[bis(2-aminophenyl)-phenylmethyl]aniline?
The canonical SMILES for 2-[bis(2-aminophenyl)-phenylmethyl]aniline is Nc1ccccc1C(c1ccccc1)(c1ccccc1N)c1ccccc1N.
What is the InChIKey of 2-[bis(2-aminophenyl)-phenylmethyl]aniline?
The InChIKey is WTQLBZPEIFKUQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3/c26-22-15-7-4-12-19(22)25(18-10-2-1-3-11-18,20-13-5-8-16-23(20)27)21-14-6-9-17-24(21)28/h1-17H,26-28H2.
What are the key properties of 2-[bis(2-aminophenyl)-phenylmethyl]aniline?
2-[bis(2-aminophenyl)-phenylmethyl]aniline has a molecular weight of 365.48 g/mol, XLogP of 4.82, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-aminophenyl)-phenylmethyl]aniline is sourced from PubChem (CID 18354124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).