N-(4-tert-butylquinazolin-7-yl)acetamide

C14H17N3O — CID 162488327

IUPACN-(4-tert-butylquinazolin-7-yl)acetamide
SMILESCC(=O)Nc1ccc2c(C(C)(C)C)ncnc2c1
InChIInChI=1S/C14H17N3O/c1-9(18)17-10-5-6-11-12(7-10)15-8-16-13(11)14(2,3)4/h5-8H,1-4H3,(H,17,18)
InChIKeyKZEXZVVDNVXFIW-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.89
Rot. Bonds1

About N-(4-tert-butylquinazolin-7-yl)acetamide

N-(4-tert-butylquinazolin-7-yl)acetamide (PubChem CID 162488327) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(4-tert-butylquinazolin-7-yl)acetamide.

Molecular Properties

Compound NameN-(4-tert-butylquinazolin-7-yl)acetamide
PubChem CID162488327
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-(4-tert-butylquinazolin-7-yl)acetamide
SMILESCC(=O)Nc1ccc2c(C(C)(C)C)ncnc2c1
InChIInChI=1S/C14H17N3O/c1-9(18)17-10-5-6-11-12(7-10)15-8-16-13(11)14(2,3)4/h5-8H,1-4H3,(H,17,18)
InChIKeyKZEXZVVDNVXFIW-UHFFFAOYSA-N
XLogP2.89
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-tert-butylbenzimidazol-5-yl)acetamide
CID 749161
N-[4-[2-[(6,7-difluoroquinazolin-4-yl)amino]ethyl]phenyl]acetamide
CID 99811987
N-[2-(dimethylamino)-4-methylquinolin-7-yl]acetamide
CID 503988
N-[4-(diethylamino)quinazolin-7-yl]prop-2-enamide
CID 155581978
4-(2-acetamidoethylamino)quinazoline-7-carboxylic acid
CID 63263209
N-[4-(3-bromoanilino)quinazolin-7-yl]-2-methylprop-2-enamide
CID 18176145
N-(2,3-dimethyl-11H-indolo[3,2-c]quinolin-9-yl)acetamide
CID 158854690
N-[3-[[6-(3-acetamidoanilino)pyrimidin-4-yl]amino]phenyl]acetamide
CID 112866710
N-(3-acetamidophenyl)-4-tert-butylbenzamide
CID 722339
N-(1,3-benzoxazol-6-yl)acetamide
CID 54228397
N-(4-acetyl-3-methylphenyl)acetamide
CID 2737381
(2R)-2-amino-3,3-dimethyl-N-quinoxalin-6-ylbutanamide
CID 103929010

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylquinazolin-7-yl)acetamide?
The IUPAC name of N-(4-tert-butylquinazolin-7-yl)acetamide (CID 162488327) is N-(4-tert-butylquinazolin-7-yl)acetamide.
What is the SMILES notation for N-(4-tert-butylquinazolin-7-yl)acetamide?
The canonical SMILES for N-(4-tert-butylquinazolin-7-yl)acetamide is CC(=O)Nc1ccc2c(C(C)(C)C)ncnc2c1.
What is the InChIKey of N-(4-tert-butylquinazolin-7-yl)acetamide?
The InChIKey is KZEXZVVDNVXFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-9(18)17-10-5-6-11-12(7-10)15-8-16-13(11)14(2,3)4/h5-8H,1-4H3,(H,17,18).
What are the key properties of N-(4-tert-butylquinazolin-7-yl)acetamide?
N-(4-tert-butylquinazolin-7-yl)acetamide has a molecular weight of 243.31 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-(4-tert-butylquinazolin-7-yl)acetamide is sourced from PubChem (CID 162488327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).