4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide

C24H32N2O2 — CID 12971739

IUPAC4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide
SMILESCOc1cc(C(C)(C)C)ccc1C(=O)Nc1cccc(C2CCCCN2C)c1
InChIInChI=1S/C24H32N2O2/c1-24(2,3)18-12-13-20(22(16-18)28-5)23(27)25-19-10-8-9-17(15-19)21-11-6-7-14-26(21)4/h8-10,12-13,15-16,21H,6-7,11,14H2,1-5H3,(H,25,27)
InChIKeyQKUFAQHLAMEBAD-UHFFFAOYSA-N
MW380.53 g/mol
LogP5.40
Rot. Bonds4

About 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide

4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide (PubChem CID 12971739) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide
PubChem CID12971739
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC Name4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide
SMILESCOc1cc(C(C)(C)C)ccc1C(=O)Nc1cccc(C2CCCCN2C)c1
InChIInChI=1S/C24H32N2O2/c1-24(2,3)18-12-13-20(22(16-18)28-5)23(27)25-19-10-8-9-17(15-19)21-11-6-7-14-26(21)4/h8-10,12-13,15-16,21H,6-7,11,14H2,1-5H3,(H,25,27)
InChIKeyQKUFAQHLAMEBAD-UHFFFAOYSA-N
XLogP5.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.53
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]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 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide?
The IUPAC name of 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide (CID 12971739) is 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide.
What is the SMILES notation for 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide?
The canonical SMILES for 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide is COc1cc(C(C)(C)C)ccc1C(=O)Nc1cccc(C2CCCCN2C)c1.
What is the InChIKey of 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide?
The InChIKey is QKUFAQHLAMEBAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c1-24(2,3)18-12-13-20(22(16-18)28-5)23(27)25-19-10-8-9-17(15-19)21-11-6-7-14-26(21)4/h8-10,12-13,15-16,21H,6-7,11,14H2,1-5H3,(H,25,27).
What are the key properties of 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide?
4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide has a molecular weight of 380.53 g/mol, XLogP of 5.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2-methoxy-N-[3-(1-methylpiperidin-2-yl)phenyl]benzamide is sourced from PubChem (CID 12971739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).