N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide

C15H19N3O3 — CID 95159752

IUPACN-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide
SMILESCOC[C@@H](C)N(C)C(=O)Cn1cnc2ccccc2c1=O
InChIInChI=1S/C15H19N3O3/c1-11(9-21-3)17(2)14(19)8-18-10-16-13-7-5-4-6-12(13)15(18)20/h4-7,10-11H,8-9H2,1-3H3/t11-/m1/s1
InChIKeyBJYABXNPBBFAKD-LLVKDONJSA-N
MW289.33 g/mol
LogP0.89
Rot. Bonds5

About N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide

N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide (PubChem CID 95159752) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide.

Molecular Properties

Compound NameN-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide
PubChem CID95159752
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC NameN-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide
SMILESCOC[C@@H](C)N(C)C(=O)Cn1cnc2ccccc2c1=O
InChIInChI=1S/C15H19N3O3/c1-11(9-21-3)17(2)14(19)8-18-10-16-13-7-5-4-6-12(13)15(18)20/h4-7,10-11H,8-9H2,1-3H3/t11-/m1/s1
InChIKeyBJYABXNPBBFAKD-LLVKDONJSA-N
XLogP0.89
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(2-methoxyphenyl)ethyl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide
CID 56745247
3-(3-methyl-2-oxobutyl)quinazolin-4-one
CID 78949362
N-[1-(1-benzofuran-2-yl)ethyl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide
CID 46551064
N-(2-cyanopropyl)-N-ethyl-2-(4-oxoquinazolin-3-yl)acetamide
CID 60513726
3-[2-(ethylamino)-3-methoxypropyl]quinazolin-4-one
CID 107506094
N-[(2R)-butan-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 7874878
N-methyl-N-[(4-methylphenyl)methyl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 4809022
[2-oxo-2-(N-propan-2-ylanilino)ethyl] 2-(4-oxoquinazolin-3-yl)acetate
CID 7995397
N-methyl-N-(2-methylpropyl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 134058897
(2R,3R)-3-methyl-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]pentanoic acid
CID 40742824
N-(2-ethoxypyrimidin-5-yl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 122302050
N-methyl-2-(4-oxoquinazolin-3-yl)-N-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]acetamide
CID 91770731

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide?
The IUPAC name of N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide (CID 95159752) is N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide.
What is the SMILES notation for N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide?
The canonical SMILES for N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide is COC[C@@H](C)N(C)C(=O)Cn1cnc2ccccc2c1=O.
What is the InChIKey of N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide?
The InChIKey is BJYABXNPBBFAKD-LLVKDONJSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-11(9-21-3)17(2)14(19)8-18-10-16-13-7-5-4-6-12(13)15(18)20/h4-7,10-11H,8-9H2,1-3H3/t11-/m1/s1.
What are the key properties of N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide?
N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide has a molecular weight of 289.33 g/mol, XLogP of 0.89, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-methoxypropan-2-yl]-N-methyl-2-(4-oxoquinazolin-3-yl)acetamide is sourced from PubChem (CID 95159752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).