N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride

C14H19ClN4O3 — CID 119629138

IUPACN-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride
SMILESCC(C)(N)CNC(=O)Cn1c(=O)[nH]c2ccccc2c1=O.Cl
InChIInChI=1S/C14H18N4O3.ClH/c1-14(2,15)8-16-11(19)7-18-12(20)9-5-3-4-6-10(9)17-13(18)21;/h3-6H,7-8,15H2,1-2H3,(H,16,19)(H,17,21);1H
InChIKeyGUTJTAHGWKSNLF-UHFFFAOYSA-N
MW326.78 g/mol
LogP-0.03
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride

N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride (PubChem CID 119629138) has the molecular formula C14H19ClN4O3 and a molecular weight of 326.78 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride
PubChem CID119629138
Molecular FormulaC14H19ClN4O3
Molecular Weight326.78 g/mol
Exact Mass326.11
IUPAC NameN-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride
SMILESCC(C)(N)CNC(=O)Cn1c(=O)[nH]c2ccccc2c1=O.Cl
InChIInChI=1S/C14H18N4O3.ClH/c1-14(2,15)8-16-11(19)7-18-12(20)9-5-3-4-6-10(9)17-13(18)21;/h3-6H,7-8,15H2,1-2H3,(H,16,19)(H,17,21);1H
InChIKeyGUTJTAHGWKSNLF-UHFFFAOYSA-N
XLogP-0.03
TPSA109.98 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.78
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(3-methylbutyl)acetamide
CID 4064970
N-[3-(aminomethyl)pentan-3-yl]-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide
CID 119570994
2-[[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]amino]-2-methylpentanoic acid
CID 119192243
N-(1-amino-4-methylpentan-2-yl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride
CID 119587739
3-[[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]amino]butanoic acid
CID 119221288
N-(1-amino-4-methylpentan-2-yl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide
CID 119587740
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(2-piperazin-1-ylethyl)acetamide
CID 119447887
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-pyridin-3-ylacetamide
CID 4906968
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)acetamide;hydrochloride
CID 120813334
2-[4-[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]piperazin-1-yl]-N-propylacetamide
CID 55669099
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-[(2S)-2-methyl-3-pyrazol-1-ylpropyl]acetamide
CID 94798530
2-(2,4-dioxo-1H-quinazolin-3-yl)-N-(2-methyl-3-pyrazol-1-ylpropyl)acetamide
CID 47078412

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride?
The IUPAC name of N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride (CID 119629138) is N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride is CC(C)(N)CNC(=O)Cn1c(=O)[nH]c2ccccc2c1=O.Cl.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride?
The InChIKey is GUTJTAHGWKSNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O3.ClH/c1-14(2,15)8-16-11(19)7-18-12(20)9-5-3-4-6-10(9)17-13(18)21;/h3-6H,7-8,15H2,1-2H3,(H,16,19)(H,17,21);1H.
What are the key properties of N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride?
N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride has a molecular weight of 326.78 g/mol, XLogP of -0.03, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-2-(2,4-dioxo-1H-quinazolin-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 119629138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).