N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide

C23H18N4O2 — CID 71181229

IUPACN-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide
SMILESCC(=O)Nc1nc(-c2cccnc2)nc2ccc(-c3ccc(C(C)=O)cc3)cc12
InChIInChI=1S/C23H18N4O2/c1-14(28)16-5-7-17(8-6-16)18-9-10-21-20(12-18)23(25-15(2)29)27-22(26-21)19-4-3-11-24-13-19/h3-13H,1-2H3,(H,25,26,27,29)
InChIKeyRVSIYLUNTMCZGJ-UHFFFAOYSA-N
MW382.42 g/mol
LogP4.52
Rot. Bonds4

About N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide

N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide (PubChem CID 71181229) has the molecular formula C23H18N4O2 and a molecular weight of 382.42 g/mol. Its IUPAC name is N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide.

Molecular Properties

Compound NameN-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide
PubChem CID71181229
Molecular FormulaC23H18N4O2
Molecular Weight382.42 g/mol
Exact Mass382.14
IUPAC NameN-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide
SMILESCC(=O)Nc1nc(-c2cccnc2)nc2ccc(-c3ccc(C(C)=O)cc3)cc12
InChIInChI=1S/C23H18N4O2/c1-14(28)16-5-7-17(8-6-16)18-9-10-21-20(12-18)23(25-15(2)29)27-22(26-21)19-4-3-11-24-13-19/h3-13H,1-2H3,(H,25,26,27,29)
InChIKeyRVSIYLUNTMCZGJ-UHFFFAOYSA-N
XLogP4.52
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-6-(4-methylphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 71180199
acetyl acetate;6-bromo-2-pyridin-3-ylquinazolin-4-amine;N-(6-bromo-2-pyridin-3-ylquinazolin-4-yl)acetamide;methane
CID 162215624
3-[4-(methylamino)-2-pyridin-3-ylquinazolin-6-yl]phenol
CID 67297993
N-methyl-6-(3-methylsulfinylphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 71274519
6-(4-aminophenyl)-N-propan-2-yl-2-pyridin-3-ylquinazolin-4-amine
CID 89347971
6-(3-fluoro-4-iodophenyl)-N-methyl-2-pyridin-3-ylquinazolin-4-amine
CID 122494265
N-methyl-6-(3-nitrophenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 89347896
3-[4-(methylamino)-2-pyridin-3-ylquinazolin-6-yl]-N-(1,3,4-thiadiazol-2-yl)benzamide
CID 71499197
6-(5-methoxy-3-pyridinyl)-N-methyl-2-pyridin-3-ylquinazolin-4-amine
CID 71179842
N-methyl-6-(2-prop-1-en-2-ylphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 135128099
N-methyl-6-(4-propoxyphenyl)-2-pyridin-3-ylquinazolin-4-amine
CID 71179891
N,6-dimethyl-2-pyridin-3-ylquinazolin-4-amine;ethane
CID 144500540

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide?
The IUPAC name of N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide (CID 71181229) is N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide.
What is the SMILES notation for N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide?
The canonical SMILES for N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide is CC(=O)Nc1nc(-c2cccnc2)nc2ccc(-c3ccc(C(C)=O)cc3)cc12.
What is the InChIKey of N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide?
The InChIKey is RVSIYLUNTMCZGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O2/c1-14(28)16-5-7-17(8-6-16)18-9-10-21-20(12-18)23(25-15(2)29)27-22(26-21)19-4-3-11-24-13-19/h3-13H,1-2H3,(H,25,26,27,29).
What are the key properties of N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide?
N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide has a molecular weight of 382.42 g/mol, XLogP of 4.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-acetylphenyl)-2-pyridin-3-ylquinazolin-4-yl]acetamide is sourced from PubChem (CID 71181229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).