N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide

C21H24N4O2 — CID 120884912

IUPACN-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide
SMILESCc1cccc2c(=O)n(CC(=O)N(CCN)CCc3ccccc3)cnc12
InChIInChI=1S/C21H24N4O2/c1-16-6-5-9-18-20(16)23-15-25(21(18)27)14-19(26)24(13-11-22)12-10-17-7-3-2-4-8-17/h2-9,15H,10-14,22H2,1H3
InChIKeyOYYLNMGSFQZUCT-UHFFFAOYSA-N
MW364.45 g/mol
LogP1.73
Rot. Bonds7

About N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide

N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide (PubChem CID 120884912) has the molecular formula C21H24N4O2 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide
PubChem CID120884912
Molecular FormulaC21H24N4O2
Molecular Weight364.45 g/mol
Exact Mass364.19
IUPAC NameN-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide
SMILESCc1cccc2c(=O)n(CC(=O)N(CCN)CCc3ccccc3)cnc12
InChIInChI=1S/C21H24N4O2/c1-16-6-5-9-18-20(16)23-15-25(21(18)27)14-19(26)24(13-11-22)12-10-17-7-3-2-4-8-17/h2-9,15H,10-14,22H2,1H3
InChIKeyOYYLNMGSFQZUCT-UHFFFAOYSA-N
XLogP1.73
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

benzyl 2-(8-methyl-4-oxoquinazolin-3-yl)acetate
CID 27938253
2-(8-methyl-4-oxoquinazolin-3-yl)-N,N-bis(2-methylpropyl)acetamide
CID 134032469
N-benzyl-N-(furan-2-ylmethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 37428295
N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)acetamide
CID 46550497
4-(8-methyl-4-oxoquinazolin-3-yl)-N-[(5-methylthiophen-2-yl)methyl]-N-(2-phenylethyl)butanamide
CID 24555681
ethyl 2-[2-methoxyethyl-[2-(8-methyl-4-oxoquinazolin-3-yl)acetyl]amino]acetate
CID 55726466
N-(3-amino-3-oxopropyl)-N-benzyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 134016250
N-benzyl-N-ethyl-3-(8-methyl-4-oxoquinazolin-3-yl)propanamide
CID 27147978
N-(2-aminoethyl)-2-(3-methyl-4-oxophthalazin-1-yl)-N-(2-phenylethyl)acetamide
CID 120886672
3-(2-aminoethyl)-8-methylquinazolin-4-one
CID 82506522
N-[2-(tert-butylamino)-2-oxoethyl]-N-ethyl-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 31213209
[2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 2-(8-methyl-4-oxoquinazolin-3-yl)acetate
CID 46649178

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide?
The IUPAC name of N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide (CID 120884912) is N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide is Cc1cccc2c(=O)n(CC(=O)N(CCN)CCc3ccccc3)cnc12.
What is the InChIKey of N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide?
The InChIKey is OYYLNMGSFQZUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2/c1-16-6-5-9-18-20(16)23-15-25(21(18)27)14-19(26)24(13-11-22)12-10-17-7-3-2-4-8-17/h2-9,15H,10-14,22H2,1H3.
What are the key properties of N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide?
N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide has a molecular weight of 364.45 g/mol, XLogP of 1.73, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 120884912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).