N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide

C22H23N3O2 — CID 95135000

IUPACN-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2c(-c3ccccc3)ncn2C[C@H]2CCCO2)cc1
InChIInChI=1S/C22H23N3O2/c1-16(26)24-19-11-9-18(10-12-19)22-21(17-6-3-2-4-7-17)23-15-25(22)14-20-8-5-13-27-20/h2-4,6-7,9-12,15,20H,5,8,13-14H2,1H3,(H,24,26)/t20-/m1/s1
InChIKeyQWSZZZULEQJLCU-HXUWFJFHSA-N
MW361.45 g/mol
LogP4.35
Rot. Bonds5

About N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide

N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide (PubChem CID 95135000) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide
PubChem CID95135000
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2c(-c3ccccc3)ncn2C[C@H]2CCCO2)cc1
InChIInChI=1S/C22H23N3O2/c1-16(26)24-19-11-9-18(10-12-19)22-21(17-6-3-2-4-7-17)23-15-25(22)14-20-8-5-13-27-20/h2-4,6-7,9-12,15,20H,5,8,13-14H2,1H3,(H,24,26)/t20-/m1/s1
InChIKeyQWSZZZULEQJLCU-HXUWFJFHSA-N
XLogP4.35
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2,5-dimethyl-3-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]pyrrol-1-yl]acetamide
CID 50951245
3-[4-[3-(oxolan-2-ylmethyl)-5-phenylimidazol-4-yl]phenyl]prop-2-yn-1-ol
CID 50970566
5-(3,4-dimethoxyphenyl)-1-[[(2S)-oxan-2-yl]methyl]-4-phenylimidazole
CID 95138059
3-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]benzonitrile
CID 50983448
N-(4-acetylphenyl)-2-[1-[[(2S)-oxolan-2-yl]methyl]-5-phenylimidazol-2-yl]sulfanylacetamide
CID 1169947
N-(4-acetamidophenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 54815392
N-[3-(oxolan-2-ylmethyl)-4-phenyl-2-phenylimino-1,3-thiazol-5-yl]acetamide
CID 44615155
1-(oxolan-2-ylmethyl)-2,4,5-triphenylimidazole
CID 102110360
N-carbamoyl-2-[1-[[(2R)-oxolan-2-yl]methyl]-4,5-diphenylimidazol-2-yl]sulfanylacetamide
CID 40783237
4-acetamido-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 110745427
1-(4-methylphenyl)-3-[2-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-4-yl]urea
CID 41410355
N-(4-acetamidophenyl)-4,6-dimethyl-2-oxo-1-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 91822604

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide?
The IUPAC name of N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide (CID 95135000) is N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide.
What is the SMILES notation for N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide?
The canonical SMILES for N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide is CC(=O)Nc1ccc(-c2c(-c3ccccc3)ncn2C[C@H]2CCCO2)cc1.
What is the InChIKey of N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide?
The InChIKey is QWSZZZULEQJLCU-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-16(26)24-19-11-9-18(10-12-19)22-21(17-6-3-2-4-7-17)23-15-25(22)14-20-8-5-13-27-20/h2-4,6-7,9-12,15,20H,5,8,13-14H2,1H3,(H,24,26)/t20-/m1/s1.
What are the key properties of N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide?
N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide has a molecular weight of 361.45 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-[[(2R)-oxolan-2-yl]methyl]-5-phenylimidazol-4-yl]phenyl]acetamide is sourced from PubChem (CID 95135000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).