4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one

C27H33N5O4 — CID 71243555

IUPAC4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one
SMILESCc1cc(-c2cnc(Nc3cc(OCCN4CCOCC4)ccc3C)o2)cc(N2CC(C)NC2=O)c1
InChIInChI=1S/C27H33N5O4/c1-18-12-21(14-22(13-18)32-17-20(3)29-27(32)33)25-16-28-26(36-25)30-24-15-23(5-4-19(24)2)35-11-8-31-6-9-34-10-7-31/h4-5,12-16,20H,6-11,17H2,1-3H3,(H,28,30)(H,29,33)
InChIKeySIVBBYACVVOACM-UHFFFAOYSA-N
MW491.59 g/mol
LogP4.33
Rot. Bonds8

About 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one

4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one (PubChem CID 71243555) has the molecular formula C27H33N5O4 and a molecular weight of 491.59 g/mol. Its IUPAC name is 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one
PubChem CID71243555
Molecular FormulaC27H33N5O4
Molecular Weight491.59 g/mol
Exact Mass491.25
IUPAC Name4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one
SMILESCc1cc(-c2cnc(Nc3cc(OCCN4CCOCC4)ccc3C)o2)cc(N2CC(C)NC2=O)c1
InChIInChI=1S/C27H33N5O4/c1-18-12-21(14-22(13-18)32-17-20(3)29-27(32)33)25-16-28-26(36-25)30-24-15-23(5-4-19(24)2)35-11-8-31-6-9-34-10-7-31/h4-5,12-16,20H,6-11,17H2,1-3H3,(H,28,30)(H,29,33)
InChIKeySIVBBYACVVOACM-UHFFFAOYSA-N
XLogP4.33
TPSA92.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500491.59
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one with MolForge

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Launch Full Analysis

Related Compounds

4-methyl-3-[4-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]-2-pyridinyl]-1H-pyridin-2-one
CID 71243476
N-[2-methyl-5-(2-morpholin-4-ylethoxy)phenyl]-5-(4-pyrazol-1-ylphenyl)-1,3-oxazol-2-amine
CID 122444638
2-[4-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]-2-pyridinyl]-4H-1,2,4-triazol-3-one
CID 136506707
1-[3-methoxy-5-[2-[5-(3-methoxypropoxy)-2-methylanilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one
CID 71243597
3-[3-amino-5-[2-[5-[2-(dimethylamino)ethoxy]-2-methylanilino]-1,3-oxazol-5-yl]phenyl]-1H-pyridin-2-one
CID 89399355
2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-5-propan-2-yl-1,3-thiazol-4-ol
CID 91323801
2-methyl-5-(2-morpholin-4-ylethoxy)benzoic acid
CID 82165954
4-[2-[3-methoxy-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]benzamide
CID 166108173
2-methyl-4-(2-morpholin-4-ylethoxy)-N-propylaniline
CID 90993901
4-[2-[(2-methyl-1-benzofuran-6-yl)oxy]ethyl]morpholine
CID 143026753
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
4-[2-[4-[4-(cyclopropylmethyl)-1,3-oxazol-5-yl]phenoxy]ethyl]morpholine
CID 163307185

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one?
The IUPAC name of 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one (CID 71243555) is 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one.
What is the SMILES notation for 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one?
The canonical SMILES for 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one is Cc1cc(-c2cnc(Nc3cc(OCCN4CCOCC4)ccc3C)o2)cc(N2CC(C)NC2=O)c1.
What is the InChIKey of 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one?
The InChIKey is SIVBBYACVVOACM-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N5O4/c1-18-12-21(14-22(13-18)32-17-20(3)29-27(32)33)25-16-28-26(36-25)30-24-15-23(5-4-19(24)2)35-11-8-31-6-9-34-10-7-31/h4-5,12-16,20H,6-11,17H2,1-3H3,(H,28,30)(H,29,33).
What are the key properties of 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one?
4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one has a molecular weight of 491.59 g/mol, XLogP of 4.33, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[3-methyl-5-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]phenyl]imidazolidin-2-one is sourced from PubChem (CID 71243555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).