N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide

C24H30N2O — CID 10594839

IUPACN,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide
SMILESCCN(CC)C(=O)c1ccc(C(=C2CCN(C)CC2)c2ccccc2)cc1
InChIInChI=1S/C24H30N2O/c1-4-26(5-2)24(27)22-13-11-20(12-14-22)23(19-9-7-6-8-10-19)21-15-17-25(3)18-16-21/h6-14H,4-5,15-18H2,1-3H3
InChIKeyZREUYGHIRGMBCR-UHFFFAOYSA-N
MW362.52 g/mol
LogP4.70
Rot. Bonds5

About N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide

N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide (PubChem CID 10594839) has the molecular formula C24H30N2O and a molecular weight of 362.52 g/mol. Its IUPAC name is N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide
PubChem CID10594839
Molecular FormulaC24H30N2O
Molecular Weight362.52 g/mol
Exact Mass362.24
IUPAC NameN,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide
SMILESCCN(CC)C(=O)c1ccc(C(=C2CCN(C)CC2)c2ccccc2)cc1
InChIInChI=1S/C24H30N2O/c1-4-26(5-2)24(27)22-13-11-20(12-14-22)23(19-9-7-6-8-10-19)21-15-17-25(3)18-16-21/h6-14H,4-5,15-18H2,1-3H3
InChIKeyZREUYGHIRGMBCR-UHFFFAOYSA-N
XLogP4.70
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.52
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide?
The IUPAC name of N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide (CID 10594839) is N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide.
What is the SMILES notation for N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide?
The canonical SMILES for N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide is CCN(CC)C(=O)c1ccc(C(=C2CCN(C)CC2)c2ccccc2)cc1.
What is the InChIKey of N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide?
The InChIKey is ZREUYGHIRGMBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N2O/c1-4-26(5-2)24(27)22-13-11-20(12-14-22)23(19-9-7-6-8-10-19)21-15-17-25(3)18-16-21/h6-14H,4-5,15-18H2,1-3H3.
What are the key properties of N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide?
N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide has a molecular weight of 362.52 g/mol, XLogP of 4.70, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[(1-methylpiperidin-4-ylidene)-phenylmethyl]benzamide is sourced from PubChem (CID 10594839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).