N-(2,6-dichloroquinazolin-4-yl)acetamide

C10H7Cl2N3O — CID 133062371

IUPACN-(2,6-dichloroquinazolin-4-yl)acetamide
SMILESCC(=O)Nc1nc(Cl)nc2ccc(Cl)cc12
InChIInChI=1S/C10H7Cl2N3O/c1-5(16)13-9-7-4-6(11)2-3-8(7)14-10(12)15-9/h2-4H,1H3,(H,13,14,15,16)
InChIKeyDRULYWRGQJJLRI-UHFFFAOYSA-N
MW256.09 g/mol
LogP2.89
Rot. Bonds1

About N-(2,6-dichloroquinazolin-4-yl)acetamide

N-(2,6-dichloroquinazolin-4-yl)acetamide (PubChem CID 133062371) has the molecular formula C10H7Cl2N3O and a molecular weight of 256.09 g/mol. Its IUPAC name is N-(2,6-dichloroquinazolin-4-yl)acetamide.

Molecular Properties

Compound NameN-(2,6-dichloroquinazolin-4-yl)acetamide
PubChem CID133062371
Molecular FormulaC10H7Cl2N3O
Molecular Weight256.09 g/mol
Exact Mass255.00
IUPAC NameN-(2,6-dichloroquinazolin-4-yl)acetamide
SMILESCC(=O)Nc1nc(Cl)nc2ccc(Cl)cc12
InChIInChI=1S/C10H7Cl2N3O/c1-5(16)13-9-7-4-6(11)2-3-8(7)14-10(12)15-9/h2-4H,1H3,(H,13,14,15,16)
InChIKeyDRULYWRGQJJLRI-UHFFFAOYSA-N
XLogP2.89
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.09
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-bromo-2-chloroquinazolin-4-yl)acetamide
CID 133061494
2-[(2,6-dichloroquinazolin-4-yl)amino]ethanesulfonamide
CID 45380048
N-(7-chloro-2-oxo-1H-quinazolin-4-yl)acetamide
CID 133057640
1-(4,6-dichloro-2-methylquinolin-3-yl)ethanone
CID 139937864
N-(6-chloro-4-phenylquinolin-3-yl)acetamide
CID 10424681
2-[(2,6-dichloroquinazolin-4-yl)amino]-N-methyl-N-phenylethanesulfonamide
CID 45380043
2,6-dichloro-4-[(2,6-dichloroquinazolin-4-yl)diselanyl]quinazoline
CID 71496121
N'-(2-chloro-6-methylquinazolin-4-yl)benzohydrazide
CID 42864303
methyl 4,6-dichloroquinazoline-2-carboxylate
CID 131622673
6-chloro-4-methylquinazoline-2-carboxylic acid
CID 84788769
6-chloro-1-methylbenzimidazole-2-carboxylic acid
CID 83868060
2,7-dichloro-N-propan-2-ylquinazolin-4-amine
CID 114693126

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichloroquinazolin-4-yl)acetamide?
The IUPAC name of N-(2,6-dichloroquinazolin-4-yl)acetamide (CID 133062371) is N-(2,6-dichloroquinazolin-4-yl)acetamide.
What is the SMILES notation for N-(2,6-dichloroquinazolin-4-yl)acetamide?
The canonical SMILES for N-(2,6-dichloroquinazolin-4-yl)acetamide is CC(=O)Nc1nc(Cl)nc2ccc(Cl)cc12.
What is the InChIKey of N-(2,6-dichloroquinazolin-4-yl)acetamide?
The InChIKey is DRULYWRGQJJLRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7Cl2N3O/c1-5(16)13-9-7-4-6(11)2-3-8(7)14-10(12)15-9/h2-4H,1H3,(H,13,14,15,16).
What are the key properties of N-(2,6-dichloroquinazolin-4-yl)acetamide?
N-(2,6-dichloroquinazolin-4-yl)acetamide has a molecular weight of 256.09 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichloroquinazolin-4-yl)acetamide is sourced from PubChem (CID 133062371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).