N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine

C18H26N4O — CID 56703312

IUPACN-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCC(CN(C)Cc1ccc(-n2ccnc2)cc1)N1CCOCC1
InChIInChI=1S/C18H26N4O/c1-16(21-9-11-23-12-10-21)13-20(2)14-17-3-5-18(6-4-17)22-8-7-19-15-22/h3-8,15-16H,9-14H2,1-2H3
InChIKeyGEALUZVGLDKENT-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.02
Rot. Bonds6

About N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine

N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine (PubChem CID 56703312) has the molecular formula C18H26N4O and a molecular weight of 314.43 g/mol. Its IUPAC name is N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound NameN-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine
PubChem CID56703312
Molecular FormulaC18H26N4O
Molecular Weight314.43 g/mol
Exact Mass314.21
IUPAC NameN-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCC(CN(C)Cc1ccc(-n2ccnc2)cc1)N1CCOCC1
InChIInChI=1S/C18H26N4O/c1-16(21-9-11-23-12-10-21)13-20(2)14-17-3-5-18(6-4-17)22-8-7-19-15-22/h3-8,15-16H,9-14H2,1-2H3
InChIKeyGEALUZVGLDKENT-UHFFFAOYSA-N
XLogP2.02
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine 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-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine?
The IUPAC name of N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine (CID 56703312) is N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine?
The canonical SMILES for N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine is CC(CN(C)Cc1ccc(-n2ccnc2)cc1)N1CCOCC1.
What is the InChIKey of N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine?
The InChIKey is GEALUZVGLDKENT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O/c1-16(21-9-11-23-12-10-21)13-20(2)14-17-3-5-18(6-4-17)22-8-7-19-15-22/h3-8,15-16H,9-14H2,1-2H3.
What are the key properties of N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine?
N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine has a molecular weight of 314.43 g/mol, XLogP of 2.02, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-imidazol-1-ylphenyl)methyl]-N-methyl-2-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 56703312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).