N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide

C19H19N5O2 — CID 110437368

IUPACN-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN(C)c2ncnc3ccccc23)cc1
InChIInChI=1S/C19H19N5O2/c1-13(25)22-14-7-9-15(10-8-14)23-18(26)11-24(2)19-16-5-3-4-6-17(16)20-12-21-19/h3-10,12H,11H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyWNDVZFXTMZBHLD-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.66
Rot. Bonds5

About N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide

N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide (PubChem CID 110437368) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
PubChem CID110437368
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC NameN-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CN(C)c2ncnc3ccccc23)cc1
InChIInChI=1S/C19H19N5O2/c1-13(25)22-14-7-9-15(10-8-14)23-18(26)11-24(2)19-16-5-3-4-6-17(16)20-12-21-19/h3-10,12H,11H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyWNDVZFXTMZBHLD-UHFFFAOYSA-N
XLogP2.66
TPSA87.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-tert-butylphenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
CID 110437388
N-(4-ethylphenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
CID 110437352
N-(3-acetylphenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
CID 110437365
N-(3-methylphenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
CID 110437347
N-(3-chloro-4-methylphenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
CID 110437356
2-[methyl(quinazolin-4-yl)amino]-N-naphthalen-1-ylacetamide
CID 17455628
N-(4-acetamidophenyl)-2-[1,3-benzothiazol-2-yl(methyl)amino]acetamide
CID 90605410
N-(1,3-benzodioxol-5-ylmethyl)-2-[methyl(quinazolin-4-yl)amino]acetamide
CID 110436403
N-[(2-aminophenyl)methyl]-N-methylquinazolin-4-amine
CID 60894383
1,3-diphenyl-1-quinazolin-4-ylurea
CID 122214993
4-[methyl-[2-(methylamino)-2-oxoethyl]amino]quinazoline-7-carboxylic acid
CID 63263648
2-[(6-bromoquinazolin-4-yl)-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 86946093

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide (CID 110437368) is N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide is CC(=O)Nc1ccc(NC(=O)CN(C)c2ncnc3ccccc23)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide?
The InChIKey is WNDVZFXTMZBHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c1-13(25)22-14-7-9-15(10-8-14)23-18(26)11-24(2)19-16-5-3-4-6-17(16)20-12-21-19/h3-10,12H,11H2,1-2H3,(H,22,25)(H,23,26).
What are the key properties of N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide?
N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide has a molecular weight of 349.39 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[methyl(quinazolin-4-yl)amino]acetamide is sourced from PubChem (CID 110437368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).