N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide

C26H27N3O4 — CID 4222132

IUPACN-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide
SMILESCOCCN(CC(=O)N1CC(=O)N(c2cccc(C)c2)C1)C(=O)c1cccc2ccccc12
InChIInChI=1S/C26H27N3O4/c1-19-7-5-10-21(15-19)29-18-28(17-25(29)31)24(30)16-27(13-14-33-2)26(32)23-12-6-9-20-8-3-4-11-22(20)23/h3-12,15H,13-14,16-18H2,1-2H3
InChIKeyVJRVMRBSGOJCCN-UHFFFAOYSA-N
MW445.52 g/mol
LogP3.07
Rot. Bonds7

About N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide

N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide (PubChem CID 4222132) has the molecular formula C26H27N3O4 and a molecular weight of 445.52 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide
PubChem CID4222132
Molecular FormulaC26H27N3O4
Molecular Weight445.52 g/mol
Exact Mass445.20
IUPAC NameN-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide
SMILESCOCCN(CC(=O)N1CC(=O)N(c2cccc(C)c2)C1)C(=O)c1cccc2ccccc12
InChIInChI=1S/C26H27N3O4/c1-19-7-5-10-21(15-19)29-18-28(17-25(29)31)24(30)16-27(13-14-33-2)26(32)23-12-6-9-20-8-3-4-11-22(20)23/h3-12,15H,13-14,16-18H2,1-2H3
InChIKeyVJRVMRBSGOJCCN-UHFFFAOYSA-N
XLogP3.07
TPSA70.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.52
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[2-[3-(3-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methoxyethyl)benzamide
CID 3324074
3-benzyl-1-(2-methoxyethyl)-1-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]urea
CID 3949694
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2-methoxyethyl)naphthalene-1-carboxamide
CID 42705950
N-butyl-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-2,2-diphenylacetamide
CID 4258893
N-[2-[3-(3-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-cyclopentyl-N-(2-methoxyethyl)propanamide
CID 3496333
N-[2-[3-(3-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-2-ethyl-N-(2-methoxyethyl)hexanamide
CID 4183545
N-[2-[3-(2,3-dimethylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-3-hydroxy-N-(2-methoxyethyl)-4-methylbenzamide
CID 70861165
4-bromo-N-[2-[3-(3-chloro-2-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methoxyethyl)benzamide
CID 3376374
N-[2-[3-(3-chloro-2-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methoxyethyl)-2-phenylbutanamide
CID 4126436
N-[2-[3-(3-chloro-2-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methoxyethyl)-3-phenylpropanamide
CID 3460978
N-[2-[3-(3-chlorophenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]-2-methoxy-N-propan-2-ylbenzamide
CID 42770524
3-chloro-N-[2-[3-[(4-chlorophenyl)methyl]-4-oxoimidazolidin-1-yl]-2-oxoethyl]-N-(2-methoxyethyl)benzamide
CID 59434037

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide (CID 4222132) is N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide is COCCN(CC(=O)N1CC(=O)N(c2cccc(C)c2)C1)C(=O)c1cccc2ccccc12.
What is the InChIKey of N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide?
The InChIKey is VJRVMRBSGOJCCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O4/c1-19-7-5-10-21(15-19)29-18-28(17-25(29)31)24(30)16-27(13-14-33-2)26(32)23-12-6-9-20-8-3-4-11-22(20)23/h3-12,15H,13-14,16-18H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide?
N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide has a molecular weight of 445.52 g/mol, XLogP of 3.07, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[2-[3-(3-methylphenyl)-4-oxoimidazolidin-1-yl]-2-oxoethyl]naphthalene-1-carboxamide is sourced from PubChem (CID 4222132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).