N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide

C20H24N2O4 — CID 8750850

IUPACN-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide
SMILESCCNC(=O)[C@@H](C)NC(=O)c1ccc(OCc2ccccc2)c(OC)c1
InChIInChI=1S/C20H24N2O4/c1-4-21-19(23)14(2)22-20(24)16-10-11-17(18(12-16)25-3)26-13-15-8-6-5-7-9-15/h5-12,14H,4,13H2,1-3H3,(H,21,23)(H,22,24)/t14-/m1/s1
InChIKeyUMOCPXOIJQBISN-CQSZACIVSA-N
MW356.42 g/mol
LogP2.53
Rot. Bonds8

About N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide

N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide (PubChem CID 8750850) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide
PubChem CID8750850
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide
SMILESCCNC(=O)[C@@H](C)NC(=O)c1ccc(OCc2ccccc2)c(OC)c1
InChIInChI=1S/C20H24N2O4/c1-4-21-19(23)14(2)22-20(24)16-10-11-17(18(12-16)25-3)26-13-15-8-6-5-7-9-15/h5-12,14H,4,13H2,1-3H3,(H,21,23)(H,22,24)/t14-/m1/s1
InChIKeyUMOCPXOIJQBISN-CQSZACIVSA-N
XLogP2.53
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-3-(4-hydroxyphenyl)-2-[(3-methoxy-4-phenylmethoxybenzoyl)amino]propanoic acid
CID 2577208
2-chloro-N-[1-[(3-methoxy-4-phenylmethoxyphenyl)methylamino]-1-oxopropan-2-yl]benzamide
CID 55381424
N-[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide
CID 86881492
N-[(1R)-1-(furan-2-yl)ethyl]-3-methoxy-4-phenylmethoxybenzamide
CID 9481817
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-(methoxymethyl)benzamide
CID 9470580
3-methoxy-N-phenyl-4-phenylmethoxybenzamide
CID 5161412
4-butoxy-3-methoxy-N-[1-oxo-1-(propylamino)propan-2-yl]benzamide
CID 46655429
4-ethoxy-3-methoxy-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 1243127
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(methoxymethyl)benzamide
CID 8751184
N-[(1S)-2-(dimethylamino)-1-phenylethyl]-3-methoxy-4-phenylmethoxybenzamide
CID 8936655
2-[(4-ethoxy-3-methoxybenzoyl)amino]propanoic acid
CID 43092046
N'-(4-ethoxybenzoyl)-3-methoxy-4-phenylmethoxybenzohydrazide
CID 9492724

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide?
The IUPAC name of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide (CID 8750850) is N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide.
What is the SMILES notation for N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide?
The canonical SMILES for N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide is CCNC(=O)[C@@H](C)NC(=O)c1ccc(OCc2ccccc2)c(OC)c1.
What is the InChIKey of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide?
The InChIKey is UMOCPXOIJQBISN-CQSZACIVSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-4-21-19(23)14(2)22-20(24)16-10-11-17(18(12-16)25-3)26-13-15-8-6-5-7-9-15/h5-12,14H,4,13H2,1-3H3,(H,21,23)(H,22,24)/t14-/m1/s1.
What are the key properties of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide?
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide has a molecular weight of 356.42 g/mol, XLogP of 2.53, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-methoxy-4-phenylmethoxybenzamide is sourced from PubChem (CID 8750850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).