N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide

C19H20N4O2 — CID 137264386

IUPACN-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide
SMILESCCN(Cc1ccccc1)C(=O)CNc1nc2ccccc2c(=O)[nH]1
InChIInChI=1S/C19H20N4O2/c1-2-23(13-14-8-4-3-5-9-14)17(24)12-20-19-21-16-11-7-6-10-15(16)18(25)22-19/h3-11H,2,12-13H2,1H3,(H2,20,21,22,25)
InChIKeyVZVJKPNXMYJWFY-UHFFFAOYSA-N
MW336.39 g/mol
LogP2.38
Rot. Bonds6

About N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide

N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide (PubChem CID 137264386) has the molecular formula C19H20N4O2 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide
PubChem CID137264386
Molecular FormulaC19H20N4O2
Molecular Weight336.39 g/mol
Exact Mass336.16
IUPAC NameN-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide
SMILESCCN(Cc1ccccc1)C(=O)CNc1nc2ccccc2c(=O)[nH]1
InChIInChI=1S/C19H20N4O2/c1-2-23(13-14-8-4-3-5-9-14)17(24)12-20-19-21-16-11-7-6-10-15(16)18(25)22-19/h3-11H,2,12-13H2,1H3,(H2,20,21,22,25)
InChIKeyVZVJKPNXMYJWFY-UHFFFAOYSA-N
XLogP2.38
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide
CID 137264056
2-(propylamino)-3H-quinazolin-4-one
CID 135439661
2-chloro-N-ethyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide;hydrochloride
CID 146086015
2-[2-[ethyl(2-hydroxyethyl)amino]ethylamino]-3H-quinazolin-4-one
CID 137266334
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254
2,4-dichloro-N-[2-[ethyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]-2-oxoethyl]benzamide
CID 135953923
N-[(4-oxo-3H-quinazolin-2-yl)methyl]-N-(2-phenylethyl)propanamide
CID 135527538
N-ethyl-2-(3-ethylphenoxy)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide
CID 135821082
N-[2-[ethyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]-2-oxoethyl]-4-phenoxybenzamide
CID 135687208
(2S)-2-amino-N-[2-[ethyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]-2-oxoethyl]-3-methylbutanamide;hydrochloride
CID 137050015
methyl 2-[2-[benzyl(ethyl)amino]-2-oxoethyl]-4-oxo-3H-quinazoline-7-carboxylate
CID 154754301
2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
CID 60962477

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide?
The IUPAC name of N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide (CID 137264386) is N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide.
What is the SMILES notation for N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide?
The canonical SMILES for N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide is CCN(Cc1ccccc1)C(=O)CNc1nc2ccccc2c(=O)[nH]1.
What is the InChIKey of N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide?
The InChIKey is VZVJKPNXMYJWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-2-23(13-14-8-4-3-5-9-14)17(24)12-20-19-21-16-11-7-6-10-15(16)18(25)22-19/h3-11H,2,12-13H2,1H3,(H2,20,21,22,25).
What are the key properties of N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide?
N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide has a molecular weight of 336.39 g/mol, XLogP of 2.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-2-[(4-oxo-3H-quinazolin-2-yl)amino]acetamide is sourced from PubChem (CID 137264386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).