N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide

C25H25N3O3 — CID 42711604

IUPACN-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide
SMILESCOCCN(C(=O)c1ccc2ccccc2c1)C(C)c1nc2ccccc2c(=O)n1C
InChIInChI=1S/C25H25N3O3/c1-17(23-26-22-11-7-6-10-21(22)25(30)27(23)2)28(14-15-31-3)24(29)20-13-12-18-8-4-5-9-19(18)16-20/h4-13,16-17H,14-15H2,1-3H3
InChIKeyDBEBQRBPBROXPH-UHFFFAOYSA-N
MW415.49 g/mol
LogP3.94
Rot. Bonds6

About N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide

N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide (PubChem CID 42711604) has the molecular formula C25H25N3O3 and a molecular weight of 415.49 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide
PubChem CID42711604
Molecular FormulaC25H25N3O3
Molecular Weight415.49 g/mol
Exact Mass415.19
IUPAC NameN-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide
SMILESCOCCN(C(=O)c1ccc2ccccc2c1)C(C)c1nc2ccccc2c(=O)n1C
InChIInChI=1S/C25H25N3O3/c1-17(23-26-22-11-7-6-10-21(22)25(30)27(23)2)28(14-15-31-3)24(29)20-13-12-18-8-4-5-9-19(18)16-20/h4-13,16-17H,14-15H2,1-3H3
InChIKeyDBEBQRBPBROXPH-UHFFFAOYSA-N
XLogP3.94
TPSA64.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.49
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]ethyl]-N-(3-methoxypropyl)naphthalene-2-carboxamide
CID 42728594
N-methyl-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide
CID 42711578
N-[1-(6-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]-N-propylnaphthalene-2-carboxamide
CID 42713947
N-[1-[3-(4-bromophenyl)-4-oxoquinazolin-2-yl]propyl]-N-(2-methoxyethyl)naphthalene-2-carboxamide
CID 42719837
3,4-dichloro-N-[1-(3-ethyl-4-oxoquinazolin-2-yl)ethyl]-N-(3-methoxypropyl)benzamide
CID 42729100
N-ethyl-N-[1-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]naphthalene-2-carboxamide
CID 42720907
N-butyl-4-chloro-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]benzamide
CID 42711515
N-[1-(3-benzyl-4-oxoquinazolin-2-yl)ethyl]-N-(2-methoxyethyl)-3-(trifluoromethyl)benzamide
CID 42711404
N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)propyl]cyclopropanecarboxamide
CID 42711971
N-[1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]-N-(3-methoxypropyl)-4-methylbenzamide
CID 42728218
N-(2-methoxyethyl)-N-[1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]ethyl]-2-phenoxyacetamide
CID 42713207
N-(2-methoxyethyl)-N-[1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]propyl]-1,3-benzodioxole-5-carboxamide
CID 42713661

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide (CID 42711604) is N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide is COCCN(C(=O)c1ccc2ccccc2c1)C(C)c1nc2ccccc2c(=O)n1C.
What is the InChIKey of N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide?
The InChIKey is DBEBQRBPBROXPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O3/c1-17(23-26-22-11-7-6-10-21(22)25(30)27(23)2)28(14-15-31-3)24(29)20-13-12-18-8-4-5-9-19(18)16-20/h4-13,16-17H,14-15H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide?
N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide has a molecular weight of 415.49 g/mol, XLogP of 3.94, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[1-(3-methyl-4-oxoquinazolin-2-yl)ethyl]naphthalene-2-carboxamide is sourced from PubChem (CID 42711604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).