N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide

C23H24N2O3 — CID 24546581

IUPACN-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)CNC(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H24N2O3/c1-3-28-21-12-8-17(9-13-21)16-25(2)22(26)15-24-23(27)20-11-10-18-6-4-5-7-19(18)14-20/h4-14H,3,15-16H2,1-2H3,(H,24,27)
InChIKeyNMXMSFWZUNFHNR-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.63
Rot. Bonds7

About N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide

N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide (PubChem CID 24546581) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide
PubChem CID24546581
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)CNC(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H24N2O3/c1-3-28-21-12-8-17(9-13-21)16-25(2)22(26)15-24-23(27)20-11-10-18-6-4-5-7-19(18)14-20/h4-14H,3,15-16H2,1-2H3,(H,24,27)
InChIKeyNMXMSFWZUNFHNR-UHFFFAOYSA-N
XLogP3.63
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-4-methylbenzamide
CID 24546571
4-ethoxy-N-[2-[(4-fluorophenyl)methyl-methylamino]-2-oxoethyl]benzamide
CID 51162813
N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-methylbenzamide
CID 51161257
N-[2-(4-ethoxyphenoxy)ethyl]naphthalene-2-carboxamide
CID 9022506
[2-[benzyl(methyl)amino]-2-oxoethyl] 2-[(4-ethoxybenzoyl)amino]acetate
CID 7884860
2-[4-[[methyl(naphthalene-2-carbonyl)amino]methyl]phenoxy]acetic acid
CID 138043891
2,4-dichloro-N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]benzamide
CID 24546574
N-(4-ethoxyphenyl)naphthalene-2-carboxamide
CID 2600548
ethyl 2-(naphthalene-2-carbonylamino)acetate
CID 43007593
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-3,4-dichlorobenzamide
CID 27666006
N-[2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]naphthalene-2-carboxamide
CID 17484415
3,4-dimethoxy-N-[2-[methyl-[(4-methylphenyl)methyl]amino]-2-oxoethyl]benzamide
CID 31239710

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
The IUPAC name of N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide (CID 24546581) is N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide is CCOc1ccc(CN(C)C(=O)CNC(=O)c2ccc3ccccc3c2)cc1.
What is the InChIKey of N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
The InChIKey is NMXMSFWZUNFHNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-3-28-21-12-8-17(9-13-21)16-25(2)22(26)15-24-23(27)20-11-10-18-6-4-5-7-19(18)14-20/h4-14H,3,15-16H2,1-2H3,(H,24,27).
What are the key properties of N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.63, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide is sourced from PubChem (CID 24546581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).