5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

C20H21N3O2 — CID 72929431

IUPAC5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCOc1ccc(Oc2cccc(CN3CCc4nc[nH]c4C3)c2)cc1
InChIInChI=1S/C20H21N3O2/c1-24-16-5-7-17(8-6-16)25-18-4-2-3-15(11-18)12-23-10-9-19-20(13-23)22-14-21-19/h2-8,11,14H,9-10,12-13H2,1H3,(H,21,22)
InChIKeyCSURRFXGIBWIDI-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.77
Rot. Bonds5

About 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine

5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 72929431) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID72929431
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCOc1ccc(Oc2cccc(CN3CCc4nc[nH]c4C3)c2)cc1
InChIInChI=1S/C20H21N3O2/c1-24-16-5-7-17(8-6-16)25-18-4-2-3-15(11-18)12-23-10-9-19-20(13-23)22-14-21-19/h2-8,11,14H,9-10,12-13H2,1H3,(H,21,22)
InChIKeyCSURRFXGIBWIDI-UHFFFAOYSA-N
XLogP3.77
TPSA50.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine 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

6,7-dimethoxy-2-[[3-(4-phenoxyphenoxy)phenyl]methyl]-3,4-dihydro-1H-isoquinoline
CID 11213509
2-[[3-(4-ethoxyphenoxy)phenyl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
CID 11293038
1-[(3-methoxyphenyl)methyl]-4-[(4-methoxyphenyl)methyl]piperazine
CID 2873492
2-[[3-(4-tert-butylphenoxy)phenyl]methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline
CID 11373829
2-[4-[[3-(4-methoxyphenoxy)phenyl]methyl]piperazin-1-yl]pyridine-3-carboxylic acid
CID 141306520
2-[(3-methoxyphenyl)methyl]-3,4-dihydro-1H-pyrido[4,3-b][1,6]naphthyridine
CID 24731661
N-(2,5-dimethoxyphenyl)-6-[(3-methoxyphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine
CID 20960513
2-[[3-(4-tert-butylphenoxy)phenyl]methyl]-6-ethoxy-7-methoxy-3,4-dihydro-1H-isoquinoline
CID 11339783
N-(4-methoxyphenyl)-6-[(3-methylphenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine
CID 20960365
7-[(3-methoxyphenyl)methyl]-2-methyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-d]azepin-4-one
CID 136763941
6-[(3-bromophenyl)methyl]-N-(4-methoxyphenyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine
CID 20960358
5-[(4-piperidin-1-ylphenyl)methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 153288688

Frequently Asked Questions

What is the IUPAC name of 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 72929431) is 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is COc1ccc(Oc2cccc(CN3CCc4nc[nH]c4C3)c2)cc1.
What is the InChIKey of 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is CSURRFXGIBWIDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-24-16-5-7-17(8-6-16)25-18-4-2-3-15(11-18)12-23-10-9-19-20(13-23)22-14-21-19/h2-8,11,14H,9-10,12-13H2,1H3,(H,21,22).
What are the key properties of 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 335.41 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3-(4-methoxyphenoxy)phenyl]methyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 72929431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).