N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide

C18H21N3O3 — CID 133462272

IUPACN-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide
SMILESCNC(=O)COc1cccc(Oc2nc(C)nc3c2CCCC3)c1
InChIInChI=1S/C18H21N3O3/c1-12-20-16-9-4-3-8-15(16)18(21-12)24-14-7-5-6-13(10-14)23-11-17(22)19-2/h5-7,10H,3-4,8-9,11H2,1-2H3,(H,19,22)
InChIKeyVSYBVIBGQKANKP-UHFFFAOYSA-N
MW327.38 g/mol
LogP2.58
Rot. Bonds5

About N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide

N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide (PubChem CID 133462272) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide.

Molecular Properties

Compound NameN-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide
PubChem CID133462272
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC NameN-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide
SMILESCNC(=O)COc1cccc(Oc2nc(C)nc3c2CCCC3)c1
InChIInChI=1S/C18H21N3O3/c1-12-20-16-9-4-3-8-15(16)18(21-12)24-14-7-5-6-13(10-14)23-11-17(22)19-2/h5-7,10H,3-4,8-9,11H2,1-2H3,(H,19,22)
InChIKeyVSYBVIBGQKANKP-UHFFFAOYSA-N
XLogP2.58
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide with MolForge

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Related Compounds

methyl 2-[3-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]phenoxy]acetate
CID 133460829
N-methyl-2-(3-methylphenoxy)acetamide
CID 15943355
2-(3-but-2-ynoxyphenoxy)-N-methylacetamide
CID 75508492
N-methyl-2-[3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]acetamide
CID 100689832
2-amino-N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]acetamide
CID 43705402
2-(4-methoxyphenoxy)-N-methylacetamide
CID 606867
N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]pyridine-4-carboxamide
CID 34273229
methyl 3-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl)oxy]benzoate
CID 9112133
2-(3-acetamidophenoxy)-N-(4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[d][1,3]thiazol-2-yl)acetamide
CID 30377211
N-[3-[2-(methylamino)-2-oxoethoxy]phenyl]-1-(4-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide
CID 34271307
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-(3-methoxyphenoxy)acetamide
CID 84559858
N-methyl-2-[3-[1-(methylamino)ethyl]phenoxy]acetamide
CID 43279883

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide?
The IUPAC name of N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide (CID 133462272) is N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide.
What is the SMILES notation for N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide?
The canonical SMILES for N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide is CNC(=O)COc1cccc(Oc2nc(C)nc3c2CCCC3)c1.
What is the InChIKey of N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide?
The InChIKey is VSYBVIBGQKANKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-12-20-16-9-4-3-8-15(16)18(21-12)24-14-7-5-6-13(10-14)23-11-17(22)19-2/h5-7,10H,3-4,8-9,11H2,1-2H3,(H,19,22).
What are the key properties of N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide?
N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide has a molecular weight of 327.38 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[3-[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)oxy]phenoxy]acetamide is sourced from PubChem (CID 133462272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).