N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

C23H28N2O2 — CID 42947168

IUPACN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESO=C(NCc1ccccc1CN1CCOCC1)C1CCCc2ccccc21
InChIInChI=1S/C23H28N2O2/c26-23(22-11-5-9-18-6-3-4-10-21(18)22)24-16-19-7-1-2-8-20(19)17-25-12-14-27-15-13-25/h1-4,6-8,10,22H,5,9,11-17H2,(H,24,26)
InChIKeyMFALAYTTYJWBPI-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.26
Rot. Bonds5

About N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide (PubChem CID 42947168) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
PubChem CID42947168
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC NameN-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
SMILESO=C(NCc1ccccc1CN1CCOCC1)C1CCCc2ccccc21
InChIInChI=1S/C23H28N2O2/c26-23(22-11-5-9-18-6-3-4-10-21(18)22)24-16-19-7-1-2-8-20(19)17-25-12-14-27-15-13-25/h1-4,6-8,10,22H,5,9,11-17H2,(H,24,26)
InChIKeyMFALAYTTYJWBPI-UHFFFAOYSA-N
XLogP3.26
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide 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-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The IUPAC name of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide (CID 42947168) is N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide.
What is the SMILES notation for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The canonical SMILES for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide is O=C(NCc1ccccc1CN1CCOCC1)C1CCCc2ccccc21.
What is the InChIKey of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
The InChIKey is MFALAYTTYJWBPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O2/c26-23(22-11-5-9-18-6-3-4-10-21(18)22)24-16-19-7-1-2-8-20(19)17-25-12-14-27-15-13-25/h1-4,6-8,10,22H,5,9,11-17H2,(H,24,26).
What are the key properties of N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide?
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide has a molecular weight of 364.49 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide is sourced from PubChem (CID 42947168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).