4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline

C24H29N3 — CID 170864530

IUPAC4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline
SMILESCC(N)Cc1ccc(N(c2ccccc2)c2ccc(CC(C)N)cc2)cc1
InChIInChI=1S/C24H29N3/c1-18(25)16-20-8-12-23(13-9-20)27(22-6-4-3-5-7-22)24-14-10-21(11-15-24)17-19(2)26/h3-15,18-19H,16-17,25-26H2,1-2H3
InChIKeyLHRQYZJXEAPVHB-UHFFFAOYSA-N
MW359.52 g/mol
LogP4.94
Rot. Bonds7

About 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline

4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline (PubChem CID 170864530) has the molecular formula C24H29N3 and a molecular weight of 359.52 g/mol. Its IUPAC name is 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline.

Molecular Properties

Compound Name4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline
PubChem CID170864530
Molecular FormulaC24H29N3
Molecular Weight359.52 g/mol
Exact Mass359.24
IUPAC Name4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline
SMILESCC(N)Cc1ccc(N(c2ccccc2)c2ccc(CC(C)N)cc2)cc1
InChIInChI=1S/C24H29N3/c1-18(25)16-20-8-12-23(13-9-20)27(22-6-4-3-5-7-22)24-14-10-21(11-15-24)17-19(2)26/h3-15,18-19H,16-17,25-26H2,1-2H3
InChIKeyLHRQYZJXEAPVHB-UHFFFAOYSA-N
XLogP4.94
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.52
LogP ≤ 54.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

λ2-plumbane;1-phenylpropan-2-amine
CID 174896483
azane;1-phenylpropan-2-amine
CID 67350534
potassium;1-phenylpropan-2-amine;iodide
CID 70390373
N-[4-(2-aminopropyl)phenyl]-N-ethyl-2-methylaniline
CID 63785925
1-amino-2-phenylethanethiol;1-phenylpropan-2-amine
CID 160760295
N-[4-(2-aminopropyl)phenyl]-3-fluoro-N-methylaniline
CID 63817401
1-N,4-N-diphenyl-1-N,4-N-bis(4-propylphenyl)benzene-1,4-diamine
CID 157362668
4-(2-aminopropyl)-N-ethyl-2-fluoro-N-phenylaniline
CID 63785098
ethane;1-N,1-N,4-N,4-N-tetraphenylbenzene-1,4-diamine
CID 91310242
N-[4-(2-aminopropyl)phenyl]-2-methoxy-N-methylaniline
CID 63794199
λ2-plumbane;bis((2S)-1-phenylpropan-2-amine);sulfuric acid
CID 173242520
(2R)-1-phenylpropan-2-amine;phosphoric acid
CID 76961595

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline?
The IUPAC name of 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline (CID 170864530) is 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline.
What is the SMILES notation for 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline?
The canonical SMILES for 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline is CC(N)Cc1ccc(N(c2ccccc2)c2ccc(CC(C)N)cc2)cc1.
What is the InChIKey of 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline?
The InChIKey is LHRQYZJXEAPVHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3/c1-18(25)16-20-8-12-23(13-9-20)27(22-6-4-3-5-7-22)24-14-10-21(11-15-24)17-19(2)26/h3-15,18-19H,16-17,25-26H2,1-2H3.
What are the key properties of 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline?
4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline has a molecular weight of 359.52 g/mol, XLogP of 4.94, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropyl)-N-[4-(2-aminopropyl)phenyl]-N-phenylaniline is sourced from PubChem (CID 170864530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).