N-phenyl-2,4-di(piperidin-1-yl)aniline

C22H29N3 — CID 69351755

IUPACN-phenyl-2,4-di(piperidin-1-yl)aniline
SMILESc1ccc(Nc2ccc(N3CCCCC3)cc2N2CCCCC2)cc1
InChIInChI=1S/C22H29N3/c1-4-10-19(11-5-1)23-21-13-12-20(24-14-6-2-7-15-24)18-22(21)25-16-8-3-9-17-25/h1,4-5,10-13,18,23H,2-3,6-9,14-17H2
InChIKeyREDBZAFTYGIWAF-UHFFFAOYSA-N
MW335.50 g/mol
LogP5.41
Rot. Bonds4

About N-phenyl-2,4-di(piperidin-1-yl)aniline

N-phenyl-2,4-di(piperidin-1-yl)aniline (PubChem CID 69351755) has the molecular formula C22H29N3 and a molecular weight of 335.50 g/mol. Its IUPAC name is N-phenyl-2,4-di(piperidin-1-yl)aniline.

Molecular Properties

Compound NameN-phenyl-2,4-di(piperidin-1-yl)aniline
PubChem CID69351755
Molecular FormulaC22H29N3
Molecular Weight335.50 g/mol
Exact Mass335.24
IUPAC NameN-phenyl-2,4-di(piperidin-1-yl)aniline
SMILESc1ccc(Nc2ccc(N3CCCCC3)cc2N2CCCCC2)cc1
InChIInChI=1S/C22H29N3/c1-4-10-19(11-5-1)23-21-13-12-20(24-14-6-2-7-15-24)18-22(21)25-16-8-3-9-17-25/h1,4-5,10-13,18,23H,2-3,6-9,14-17H2
InChIKeyREDBZAFTYGIWAF-UHFFFAOYSA-N
XLogP5.41
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.50
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-phenyl-2,4-di(piperidin-1-yl)aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[2,4-di(piperidin-1-yl)phenyl]benzamide
CID 2954012
1-(4-benzyl-3-pyrrolidin-1-ylphenyl)azepane
CID 132507464
N-[4-(benzenesulfonyl)phenyl]-2-piperidin-1-ylaniline
CID 141192151
2,4-di(piperidin-1-yl)phenol
CID 130450866
N-phenyl-6-piperidin-1-yl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 90725831
1-(2-chloro-5-pyrrolidin-1-ylphenyl)pyrrolidine
CID 23660792
1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
2-bromo-1-N-(4-pyrrolidin-1-ylphenyl)benzene-1,4-diamine
CID 63179637
N-(4-anilinophenyl)-3-pyrrolidin-1-ylbenzamide
CID 168515887
N-phenyl-4-piperidin-1-ylbenzamide
CID 53282261
4-morpholin-4-yl-N-phenylaniline
CID 159018746
N-phosphanyl-3-pyrrolidin-1-ylaniline
CID 59272549

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2,4-di(piperidin-1-yl)aniline?
The IUPAC name of N-phenyl-2,4-di(piperidin-1-yl)aniline (CID 69351755) is N-phenyl-2,4-di(piperidin-1-yl)aniline.
What is the SMILES notation for N-phenyl-2,4-di(piperidin-1-yl)aniline?
The canonical SMILES for N-phenyl-2,4-di(piperidin-1-yl)aniline is c1ccc(Nc2ccc(N3CCCCC3)cc2N2CCCCC2)cc1.
What is the InChIKey of N-phenyl-2,4-di(piperidin-1-yl)aniline?
The InChIKey is REDBZAFTYGIWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3/c1-4-10-19(11-5-1)23-21-13-12-20(24-14-6-2-7-15-24)18-22(21)25-16-8-3-9-17-25/h1,4-5,10-13,18,23H,2-3,6-9,14-17H2.
What are the key properties of N-phenyl-2,4-di(piperidin-1-yl)aniline?
N-phenyl-2,4-di(piperidin-1-yl)aniline has a molecular weight of 335.50 g/mol, XLogP of 5.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2,4-di(piperidin-1-yl)aniline is sourced from PubChem (CID 69351755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).