5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide

C14H20N4O2 — CID 82010210

IUPAC5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide
SMILESCN1Cc2cc(C(N)CCCC(N)=O)ccc2NC1=O
InChIInChI=1S/C14H20N4O2/c1-18-8-10-7-9(5-6-12(10)17-14(18)20)11(15)3-2-4-13(16)19/h5-7,11H,2-4,8,15H2,1H3,(H2,16,19)(H,17,20)
InChIKeyQTTPYXIOHGPMEQ-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.32
Rot. Bonds5

About 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide

5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide (PubChem CID 82010210) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide.

Molecular Properties

Compound Name5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide
PubChem CID82010210
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide
SMILESCN1Cc2cc(C(N)CCCC(N)=O)ccc2NC1=O
InChIInChI=1S/C14H20N4O2/c1-18-8-10-7-9(5-6-12(10)17-14(18)20)11(15)3-2-4-13(16)19/h5-7,11H,2-4,8,15H2,1H3,(H2,16,19)(H,17,20)
InChIKeyQTTPYXIOHGPMEQ-UHFFFAOYSA-N
XLogP1.32
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-(1-aminohexyl)-3-methyl-1,4-dihydroquinazolin-2-one
CID 82010395
6-(1-hydroxyethyl)-3-methyl-1,4-dihydroquinazolin-2-one
CID 82009258
6-(1-hydroxyoctyl)-3-methyl-1,4-dihydroquinazolin-2-one
CID 82009925
6-(1-hydroxy-2,2-dimethylbutyl)-3-methyl-1,4-dihydroquinazolin-2-one
CID 82009726
3-methyl-6-[1-(methylamino)ethyl]-1,4-dihydroquinazolin-2-one
CID 82009574
6-(1-bromo-4,4,4-trifluorobutyl)-3-methyl-1,4-dihydroquinazolin-2-one
CID 82009735
5-hydroxy-3-methyl-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanoic acid
CID 82009697
methyl 5-amino-5-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)pentanoate
CID 60860810
3-methyl-6-(2,2,3,3,3-pentafluoro-1-hydroxypropyl)-1,4-dihydroquinazolin-2-one
CID 82009472
6-[hydroxy-(2-methylcyclopropyl)methyl]-3-methyl-1,4-dihydroquinazolin-2-one
CID 82010582
6-(4-chlorobutanoyl)-3-methyl-1,4-dihydroquinazolin-2-one
CID 105400924
6-[amino(oxan-4-yl)methyl]-3-methyl-1,4-dihydroquinazolin-2-one
CID 82009563

Frequently Asked Questions

What is the IUPAC name of 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide?
The IUPAC name of 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide (CID 82010210) is 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide.
What is the SMILES notation for 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide?
The canonical SMILES for 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide is CN1Cc2cc(C(N)CCCC(N)=O)ccc2NC1=O.
What is the InChIKey of 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide?
The InChIKey is QTTPYXIOHGPMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-18-8-10-7-9(5-6-12(10)17-14(18)20)11(15)3-2-4-13(16)19/h5-7,11H,2-4,8,15H2,1H3,(H2,16,19)(H,17,20).
What are the key properties of 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide?
5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide has a molecular weight of 276.34 g/mol, XLogP of 1.32, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-5-(3-methyl-2-oxo-1,4-dihydroquinazolin-6-yl)pentanamide is sourced from PubChem (CID 82010210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).