4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide

C22H25N5O3 — CID 47054802

IUPAC4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
SMILESCn1ccnc1COc1ccc(C(=O)NCc2ccnc(N3CCOCC3)c2)cc1
InChIInChI=1S/C22H25N5O3/c1-26-9-8-24-21(26)16-30-19-4-2-18(3-5-19)22(28)25-15-17-6-7-23-20(14-17)27-10-12-29-13-11-27/h2-9,14H,10-13,15-16H2,1H3,(H,25,28)
InChIKeyYLAVSOPLDKLVPY-UHFFFAOYSA-N
MW407.47 g/mol
LogP2.16
Rot. Bonds7

About 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide

4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide (PubChem CID 47054802) has the molecular formula C22H25N5O3 and a molecular weight of 407.47 g/mol. Its IUPAC name is 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
PubChem CID47054802
Molecular FormulaC22H25N5O3
Molecular Weight407.47 g/mol
Exact Mass407.20
IUPAC Name4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
SMILESCn1ccnc1COc1ccc(C(=O)NCc2ccnc(N3CCOCC3)c2)cc1
InChIInChI=1S/C22H25N5O3/c1-26-9-8-24-21(26)16-30-19-4-2-18(3-5-19)22(28)25-15-17-6-7-23-20(14-17)27-10-12-29-13-11-27/h2-9,14H,10-13,15-16H2,1H3,(H,25,28)
InChIKeyYLAVSOPLDKLVPY-UHFFFAOYSA-N
XLogP2.16
TPSA81.51 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide with MolForge

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Related Compounds

N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55841812
3-fluoro-4-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
CID 32586803
2-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 32585275
3-cyano-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
CID 32584541
4-[(1-methylimidazol-2-yl)methoxy]-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 55869064
3-amino-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide;dihydrochloride
CID 119846311
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
CID 32585359
N-[[6-(diethylamino)-3-pyridinyl]methyl]-4-[(1-methylimidazol-2-yl)methoxy]benzamide
CID 55848814
2,5-dimethyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
CID 32585579
4-[4-[(2-pyrrolidin-1-yl-4-pyridinyl)methylcarbamoyl]phenoxy]benzamide
CID 56545956
N-[(2-methoxy-4-pyridinyl)methyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 18167458
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]-2-(pyridine-4-carbonylamino)-1,3-oxazole-4-carboxamide
CID 72717065

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide?
The IUPAC name of 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide (CID 47054802) is 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide.
What is the SMILES notation for 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide?
The canonical SMILES for 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide is Cn1ccnc1COc1ccc(C(=O)NCc2ccnc(N3CCOCC3)c2)cc1.
What is the InChIKey of 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide?
The InChIKey is YLAVSOPLDKLVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O3/c1-26-9-8-24-21(26)16-30-19-4-2-18(3-5-19)22(28)25-15-17-6-7-23-20(14-17)27-10-12-29-13-11-27/h2-9,14H,10-13,15-16H2,1H3,(H,25,28).
What are the key properties of 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide?
4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide has a molecular weight of 407.47 g/mol, XLogP of 2.16, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methylimidazol-2-yl)methoxy]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide is sourced from PubChem (CID 47054802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).