N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide

C23H31N3O3 — CID 4796277

IUPACN-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide
SMILESCOc1cccc(NC(=O)C(NCC(C)(C)N2CCOCC2)c2ccccc2)c1
InChIInChI=1S/C23H31N3O3/c1-23(2,26-12-14-29-15-13-26)17-24-21(18-8-5-4-6-9-18)22(27)25-19-10-7-11-20(16-19)28-3/h4-11,16,21,24H,12-15,17H2,1-3H3,(H,25,27)
InChIKeyOECYJUJURGSQJL-UHFFFAOYSA-N
MW397.52 g/mol
LogP3.08
Rot. Bonds8

About N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide

N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide (PubChem CID 4796277) has the molecular formula C23H31N3O3 and a molecular weight of 397.52 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide
PubChem CID4796277
Molecular FormulaC23H31N3O3
Molecular Weight397.52 g/mol
Exact Mass397.24
IUPAC NameN-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide
SMILESCOc1cccc(NC(=O)C(NCC(C)(C)N2CCOCC2)c2ccccc2)c1
InChIInChI=1S/C23H31N3O3/c1-23(2,26-12-14-29-15-13-26)17-24-21(18-8-5-4-6-9-18)22(27)25-19-10-7-11-20(16-19)28-3/h4-11,16,21,24H,12-15,17H2,1-3H3,(H,25,27)
InChIKeyOECYJUJURGSQJL-UHFFFAOYSA-N
XLogP3.08
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.52
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-N-(3-methoxyphenyl)-2-phenylacetamide
CID 2409443
(2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-piperidin-1-ylanilino)acetamide
CID 25362284
(2R)-2-[4-(4-ethylpiperazin-1-yl)anilino]-N-(3-methoxyphenyl)-2-phenylacetamide
CID 31420058
(2S)-N-(3-methoxyphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)-2-phenylacetamide
CID 40814254
(2R)-2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-(3-methoxyphenyl)-2-phenylacetamide
CID 8696252
N-(3-methoxyphenyl)-2-[4-[(2-oxopyrrolidin-1-yl)methyl]anilino]-2-phenylacetamide
CID 87033167
2-hydroxy-N-(3-methoxyphenyl)-2-phenylacetamide
CID 82132314
(3R)-N-(4-methoxyphenyl)-3-[(2-methyl-2-morpholin-4-ylpropyl)amino]butanamide
CID 9453382
(3S)-N-(4-methoxyphenyl)-3-[(2-methyl-2-morpholin-4-ylpropyl)amino]butanamide
CID 9453380
N-(2-methyl-2-morpholin-4-ylpropyl)-2-phenoxypropanamide
CID 51163418
N-(3-methoxyphenyl)-2-[4-(morpholine-4-carbonyl)anilino]acetamide
CID 54832632
[(2R)-1-(3-methoxyanilino)-1-oxopropan-2-yl]-methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]azanium
CID 8592727

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide (CID 4796277) is N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide is COc1cccc(NC(=O)C(NCC(C)(C)N2CCOCC2)c2ccccc2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide?
The InChIKey is OECYJUJURGSQJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O3/c1-23(2,26-12-14-29-15-13-26)17-24-21(18-8-5-4-6-9-18)22(27)25-19-10-7-11-20(16-19)28-3/h4-11,16,21,24H,12-15,17H2,1-3H3,(H,25,27).
What are the key properties of N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide?
N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide has a molecular weight of 397.52 g/mol, XLogP of 3.08, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-[(2-methyl-2-morpholin-4-ylpropyl)amino]-2-phenylacetamide is sourced from PubChem (CID 4796277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).