N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide

C20H21N3O3 — CID 131931945

IUPACN-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide
SMILESCOc1ccccc1Oc1ccc(NC(=O)CCn2ccnc2C)cc1
InChIInChI=1S/C20H21N3O3/c1-15-21-12-14-23(15)13-11-20(24)22-16-7-9-17(10-8-16)26-19-6-4-3-5-18(19)25-2/h3-10,12,14H,11,13H2,1-2H3,(H,22,24)
InChIKeyFTQNSFOMUHUKSV-UHFFFAOYSA-N
MW351.41 g/mol
LogP4.02
Rot. Bonds7

About N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide

N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide (PubChem CID 131931945) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide
PubChem CID131931945
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC NameN-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide
SMILESCOc1ccccc1Oc1ccc(NC(=O)CCn2ccnc2C)cc1
InChIInChI=1S/C20H21N3O3/c1-15-21-12-14-23(15)13-11-20(24)22-16-7-9-17(10-8-16)26-19-6-4-3-5-18(19)25-2/h3-10,12,14H,11,13H2,1-2H3,(H,22,24)
InChIKeyFTQNSFOMUHUKSV-UHFFFAOYSA-N
XLogP4.02
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylpyrazol-3-yl)propanamide
CID 131900391
N-[4-(2-methoxyphenoxy)phenyl]-3-phenoxypropanamide
CID 27901730
N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide
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CID 39398752
4-(1,3-dioxoisoindol-2-yl)-N-[4-(2-methoxyphenoxy)phenyl]butanamide
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7-amino-N-[4-(2-methoxyphenoxy)phenyl]heptanamide;hydrochloride
CID 119697280
2-(2-methoxyphenyl)-N-[4-[6-(2-methylimidazol-1-yl)pyridazin-3-yl]oxyphenyl]acetamide
CID 122306741
N-[4-(2-methoxyphenoxy)phenyl]-2-(4-methoxyphenyl)acetamide
CID 27901681
N-[4-(2-methoxyphenoxy)phenyl]-2-thiophen-2-ylsulfanylacetamide
CID 43066844
N-[4-(2-methoxyphenoxy)phenyl]-3-[(2-phenylacetyl)amino]propanamide
CID 18139288
N-[4-[4-(2-methoxyphenoxy)anilino]-4-oxobutyl]-2,2-dimethylpropanamide
CID 32765837
N-[4-(2-methoxyphenoxy)phenyl]-1,2,5-trimethylpyrrole-3-carboxamide
CID 9182918

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide?
The IUPAC name of N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide (CID 131931945) is N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide.
What is the SMILES notation for N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide?
The canonical SMILES for N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide is COc1ccccc1Oc1ccc(NC(=O)CCn2ccnc2C)cc1.
What is the InChIKey of N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide?
The InChIKey is FTQNSFOMUHUKSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-15-21-12-14-23(15)13-11-20(24)22-16-7-9-17(10-8-16)26-19-6-4-3-5-18(19)25-2/h3-10,12,14H,11,13H2,1-2H3,(H,22,24).
What are the key properties of N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide?
N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide has a molecular weight of 351.41 g/mol, XLogP of 4.02, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxyphenoxy)phenyl]-3-(2-methylimidazol-1-yl)propanamide is sourced from PubChem (CID 131931945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).