2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide

C22H24N4O2 — CID 651008

IUPAC2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide
SMILESO=C(Cn1c(CN2CCCCC2)nc2ccccc2c1=O)Nc1ccccc1
InChIInChI=1S/C22H24N4O2/c27-21(23-17-9-3-1-4-10-17)16-26-20(15-25-13-7-2-8-14-25)24-19-12-6-5-11-18(19)22(26)28/h1,3-6,9-12H,2,7-8,13-16H2,(H,23,27)
InChIKeySUGZEBUQVUAGMX-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.02
Rot. Bonds5

About 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide

2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide (PubChem CID 651008) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide
PubChem CID651008
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide
SMILESO=C(Cn1c(CN2CCCCC2)nc2ccccc2c1=O)Nc1ccccc1
InChIInChI=1S/C22H24N4O2/c27-21(23-17-9-3-1-4-10-17)16-26-20(15-25-13-7-2-8-14-25)24-19-12-6-5-11-18(19)22(26)28/h1,3-6,9-12H,2,7-8,13-16H2,(H,23,27)
InChIKeySUGZEBUQVUAGMX-UHFFFAOYSA-N
XLogP3.02
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Methaqualone
CID 6292
4(3H)-Quinazolinone, 2-methyl-3-(2-methylphenyl)-, hydrochloride (1:1)
CID 63196
3-(2-Ethylphenyl)-2-methyl-4(3H)-quinazolinone
CID 23914
Azd-6703
CID 11373432
Avadomide
CID 24967599
(-)-6,7,7a,8-Tetrahydroquinazolino(3',2':1,6)pyrido(2,3-b)(1,4)benzodiazepine-9,16-dione
CID 130919
ME0328
CID 135566764
3-phenyl-3H-quinazolin-4-one
CID 785275
Arborine
CID 63123
Glycosminine
CID 135426527
1-(4-(Aminomethyl)benzoyl)-5'-fluoro-1'H-spiro(piperidine-4,2'-quinazolin)-4'-amine
CID 24894149
Trans-N-Benzyl-4-({1-[(6-Methyl-4-Oxo-4h-Pyrido[1,2-A]pyrimidin-2-Yl)methyl]-2,4-Dioxo-1,4-Dihydroquinazolin-3(2h)-Yl}methyl)cyclohexanecarboxamide
CID 15995771

Frequently Asked Questions

What is the IUPAC name of 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide?
The IUPAC name of 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide (CID 651008) is 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide?
The canonical SMILES for 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide is O=C(Cn1c(CN2CCCCC2)nc2ccccc2c1=O)Nc1ccccc1.
What is the InChIKey of 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide?
The InChIKey is SUGZEBUQVUAGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c27-21(23-17-9-3-1-4-10-17)16-26-20(15-25-13-7-2-8-14-25)24-19-12-6-5-11-18(19)22(26)28/h1,3-6,9-12H,2,7-8,13-16H2,(H,23,27).
What are the key properties of 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide?
2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide has a molecular weight of 376.46 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-oxo-2-(piperidin-1-ylmethyl)quinazolin-3-yl]-N-phenylacetamide is sourced from PubChem (CID 651008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).