N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine

C25H29N3 — CID 21352395

IUPACN-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine
SMILESCc1ccc(N(Cc2ccnc(-c3ccccc3C)c2)C2CCNCC2)cc1
InChIInChI=1S/C25H29N3/c1-19-7-9-22(10-8-19)28(23-12-14-26-15-13-23)18-21-11-16-27-25(17-21)24-6-4-3-5-20(24)2/h3-11,16-17,23,26H,12-15,18H2,1-2H3
InChIKeyVOFZAVJOOQTGGW-UHFFFAOYSA-N
MW371.53 g/mol
LogP5.12
Rot. Bonds5

About N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine

N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine (PubChem CID 21352395) has the molecular formula C25H29N3 and a molecular weight of 371.53 g/mol. Its IUPAC name is N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine.

Molecular Properties

Compound NameN-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine
PubChem CID21352395
Molecular FormulaC25H29N3
Molecular Weight371.53 g/mol
Exact Mass371.24
IUPAC NameN-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine
SMILESCc1ccc(N(Cc2ccnc(-c3ccccc3C)c2)C2CCNCC2)cc1
InChIInChI=1S/C25H29N3/c1-19-7-9-22(10-8-19)28(23-12-14-26-15-13-23)18-21-11-16-27-25(17-21)24-6-4-3-5-20(24)2/h3-11,16-17,23,26H,12-15,18H2,1-2H3
InChIKeyVOFZAVJOOQTGGW-UHFFFAOYSA-N
XLogP5.12
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.53
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine 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

N-(4-methylphenyl)-N-[(2-phenyl-4-pyridinyl)methyl]piperidin-4-amine
CID 21352397
N-(4-methylphenyl)-N-[[2-(3,4,5-trimethylphenyl)-4-pyridinyl]methyl]piperidin-4-amine
CID 21352564
N-[[2-(2-ethylphenyl)-4-pyridinyl]methyl]-N-(4-methoxyphenyl)piperidin-4-amine
CID 142218031
N-(4-bromophenyl)-N-[[2-(3,4,5-trimethylphenyl)-4-pyridinyl]methyl]piperidin-4-amine
CID 21352421
N-(4-methoxyphenyl)-N-[[2-(3-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine
CID 142217884
N-[4-(trifluoromethyl)phenyl]-N-[[2-(3,4,5-trimethylphenyl)-4-pyridinyl]methyl]piperidin-4-amine
CID 21352477
N-[(3,4-dichlorophenyl)methyl]-N-(4-methylphenyl)piperidin-4-amine
CID 23137586
N-[[2-(4-fluorophenyl)-4-pyridinyl]methyl]-N-(4-methoxyphenyl)piperidin-4-amine
CID 22558022
N-(4-methylphenyl)-N,1-bis[(2-phenyl-4-pyridinyl)methyl]piperidin-4-amine
CID 21352374
N,1-bis[[2-(3,4-dimethylphenyl)-4-pyridinyl]methyl]-N-(4-methylphenyl)piperidin-4-amine
CID 21352363
N,1-bis[[2-(3-fluorophenyl)-4-pyridinyl]methyl]-N-(4-methylphenyl)piperidin-4-amine
CID 21352365
N,1-bis[[2-(4-chlorophenyl)-4-pyridinyl]methyl]-N-(4-methylphenyl)piperidin-4-amine
CID 21352369

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine?
The IUPAC name of N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine (CID 21352395) is N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine.
What is the SMILES notation for N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine?
The canonical SMILES for N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine is Cc1ccc(N(Cc2ccnc(-c3ccccc3C)c2)C2CCNCC2)cc1.
What is the InChIKey of N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine?
The InChIKey is VOFZAVJOOQTGGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N3/c1-19-7-9-22(10-8-19)28(23-12-14-26-15-13-23)18-21-11-16-27-25(17-21)24-6-4-3-5-20(24)2/h3-11,16-17,23,26H,12-15,18H2,1-2H3.
What are the key properties of N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine?
N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine has a molecular weight of 371.53 g/mol, XLogP of 5.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N-[[2-(2-methylphenyl)-4-pyridinyl]methyl]piperidin-4-amine is sourced from PubChem (CID 21352395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).