4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide

C24H24N2O3 — CID 75451387

IUPAC4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide
SMILESCOc1ccc(C(=O)NCC2CC(=O)N(C)C2c2ccccc2)c2ccccc12
InChIInChI=1S/C24H24N2O3/c1-26-22(27)14-17(23(26)16-8-4-3-5-9-16)15-25-24(28)20-12-13-21(29-2)19-11-7-6-10-18(19)20/h3-13,17,23H,14-15H2,1-2H3,(H,25,28)
InChIKeyJYUVRDNZZKRQEJ-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.80
Rot. Bonds5

About 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide

4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide (PubChem CID 75451387) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide
PubChem CID75451387
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide
SMILESCOc1ccc(C(=O)NCC2CC(=O)N(C)C2c2ccccc2)c2ccccc12
InChIInChI=1S/C24H24N2O3/c1-26-22(27)14-17(23(26)16-8-4-3-5-9-16)15-25-24(28)20-12-13-21(29-2)19-11-7-6-10-18(19)20/h3-13,17,23H,14-15H2,1-2H3,(H,25,28)
InChIKeyJYUVRDNZZKRQEJ-UHFFFAOYSA-N
XLogP3.80
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(2S,3S)-1-methyl-5-oxo-2-phenylpyrrolidin-3-yl]methyl]-1H-indole-7-carboxamide
CID 97347224
(2R)-N-[[(2S,3S)-1-methyl-5-oxo-2-phenylpyrrolidin-3-yl]methyl]-2-(3-methyl-4-propan-2-ylphenoxy)propanamide
CID 97261954
2-[[(2-methoxyethylamino)-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methylamino]methylidene]amino]-N,N-dimethylacetamide
CID 110036139
4-methoxy-N-[2-(4-methylpiperidin-1-yl)ethyl]naphthalene-1-carboxamide
CID 112844412
N-[2-[di(propan-2-yl)amino]ethyl]-4-methoxynaphthalene-1-carboxamide
CID 18160783
5-methyl-1-[[(2R,3S)-1-methyl-5-oxo-2-phenylpyrrolidin-3-yl]methylcarbamoyl]piperidine-3-carboxylic acid
CID 122123684
N-cyclopropyl-4-methoxynaphthalene-1-carboxamide
CID 27537333
4-methoxy-N-[3-(methylamino)propyl]naphthalene-1-carboxamide
CID 119431564
2-[[N'-benzyl-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]carbamimidoyl]amino]-N,N-dimethylacetamide
CID 110036609
2-[[ethylamino-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methylamino]methylidene]amino]-N,N-dimethylacetamide;hydroiodide
CID 110035158
(2R,3R)-N-(2-methoxyphenyl)-1-methyl-5-oxo-2-phenylpyrrolidine-3-carboxamide
CID 29136953
1,3-diethyl-2-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]guanidine;hydroiodide
CID 110017679

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide?
The IUPAC name of 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide (CID 75451387) is 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide.
What is the SMILES notation for 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide?
The canonical SMILES for 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide is COc1ccc(C(=O)NCC2CC(=O)N(C)C2c2ccccc2)c2ccccc12.
What is the InChIKey of 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide?
The InChIKey is JYUVRDNZZKRQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-26-22(27)14-17(23(26)16-8-4-3-5-9-16)15-25-24(28)20-12-13-21(29-2)19-11-7-6-10-18(19)20/h3-13,17,23H,14-15H2,1-2H3,(H,25,28).
What are the key properties of 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide?
4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(1-methyl-5-oxo-2-phenylpyrrolidin-3-yl)methyl]naphthalene-1-carboxamide is sourced from PubChem (CID 75451387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).