4-amino-1-propan-2-ylquinazolin-2-one

C11H13N3O — CID 156889369

IUPAC4-amino-1-propan-2-ylquinazolin-2-one
SMILESCC(C)n1c(=O)nc(N)c2ccccc21
InChIInChI=1S/C11H13N3O/c1-7(2)14-9-6-4-3-5-8(9)10(12)13-11(14)15/h3-7H,1-2H3,(H2,12,13,15)
InChIKeyDPZGJXVCFBQVAI-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.56
Rot. Bonds1

About 4-amino-1-propan-2-ylquinazolin-2-one

4-amino-1-propan-2-ylquinazolin-2-one (PubChem CID 156889369) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 4-amino-1-propan-2-ylquinazolin-2-one.

Molecular Properties

Compound Name4-amino-1-propan-2-ylquinazolin-2-one
PubChem CID156889369
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name4-amino-1-propan-2-ylquinazolin-2-one
SMILESCC(C)n1c(=O)nc(N)c2ccccc21
InChIInChI=1S/C11H13N3O/c1-7(2)14-9-6-4-3-5-8(9)10(12)13-11(14)15/h3-7H,1-2H3,(H2,12,13,15)
InChIKeyDPZGJXVCFBQVAI-UHFFFAOYSA-N
XLogP1.56
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-methylphenyl)-1-propan-2-ylquinazolin-2-one
CID 125483876
3-iodo-2-methyl-1-propan-2-ylquinolin-4-one
CID 176548683
3-amino-4-propan-2-ylfuro[3,2-b]quinolin-9-one
CID 149001224
6-propan-2-ylbenzo[c][2,7]naphthyridin-5-one
CID 154465601
4-propan-2-yl-[1,3]thiazolo[5,4-b]indole
CID 153310438
11-propan-2-ylbenzo[a]carbazole
CID 118058944
4-propan-2-ylthieno[3,2-b]indol-3-amine
CID 147058333
ethane;2-methylpropane;4-propan-2-yl-[1,3]thiazolo[5,4-b]indole
CID 167636104
ethane;(2Z,4Z)-hexa-2,4-diene;9-propan-2-ylcarbazole
CID 165044718
9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole
CID 170205010
3-fluoro-2-methyl-1-propan-2-ylindole
CID 150270032
1-[(1-propan-2-ylpyrazol-3-yl)methyl]indazol-3-amine
CID 64773024

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-propan-2-ylquinazolin-2-one?
The IUPAC name of 4-amino-1-propan-2-ylquinazolin-2-one (CID 156889369) is 4-amino-1-propan-2-ylquinazolin-2-one.
What is the SMILES notation for 4-amino-1-propan-2-ylquinazolin-2-one?
The canonical SMILES for 4-amino-1-propan-2-ylquinazolin-2-one is CC(C)n1c(=O)nc(N)c2ccccc21.
What is the InChIKey of 4-amino-1-propan-2-ylquinazolin-2-one?
The InChIKey is DPZGJXVCFBQVAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-7(2)14-9-6-4-3-5-8(9)10(12)13-11(14)15/h3-7H,1-2H3,(H2,12,13,15).
What are the key properties of 4-amino-1-propan-2-ylquinazolin-2-one?
4-amino-1-propan-2-ylquinazolin-2-one has a molecular weight of 203.25 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-propan-2-ylquinazolin-2-one is sourced from PubChem (CID 156889369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).