N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide

C19H22N2O3 — CID 1255249

IUPACN-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide
SMILESCCCC(=O)Nc1ccccc1NC(=O)[C@@H](C)Oc1ccccc1
InChIInChI=1S/C19H22N2O3/c1-3-9-18(22)20-16-12-7-8-13-17(16)21-19(23)14(2)24-15-10-5-4-6-11-15/h4-8,10-14H,3,9H2,1-2H3,(H,20,22)(H,21,23)/t14-/m1/s1
InChIKeyLXEIECVJTOAHGF-CQSZACIVSA-N
MW326.40 g/mol
LogP3.83
Rot. Bonds7

About N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide

N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide (PubChem CID 1255249) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide.

Molecular Properties

Compound NameN-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide
PubChem CID1255249
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide
SMILESCCCC(=O)Nc1ccccc1NC(=O)[C@@H](C)Oc1ccccc1
InChIInChI=1S/C19H22N2O3/c1-3-9-18(22)20-16-12-7-8-13-17(16)21-19(23)14(2)24-15-10-5-4-6-11-15/h4-8,10-14H,3,9H2,1-2H3,(H,20,22)(H,21,23)/t14-/m1/s1
InChIKeyLXEIECVJTOAHGF-CQSZACIVSA-N
XLogP3.83
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-phenoxypropanoylamino)phenyl]butanamide
CID 2977242
N-[2-[[(2R)-2-(3-chlorophenoxy)propanoyl]amino]phenyl]butanamide
CID 1313437
N-naphthalen-1-yl-2-phenoxypropanamide
CID 2794096
N-(2-ethylsulfanylphenyl)-2-phenoxypropanamide
CID 132650139
2-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 1336329
(2R)-N-(2-iodophenyl)-2-phenoxypropanamide
CID 1124071
N-(2-chlorophenyl)-2-phenoxypropanamide
CID 2897832
(2R)-N-(2-chlorophenyl)-2-phenoxypropanamide
CID 837154
(2R)-2-(4-methylphenoxy)-N-[2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]phenyl]propanamide
CID 1019889
N-(2-ethylphenyl)-2-(4-phenylphenoxy)propanamide
CID 19191511
2-(4-ethylphenoxy)-N-naphthalen-1-ylpropanamide
CID 4953259
N-(2,3-dichlorophenyl)-2-phenoxypropanamide
CID 2897939

Frequently Asked Questions

What is the IUPAC name of N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide?
The IUPAC name of N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide (CID 1255249) is N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide.
What is the SMILES notation for N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide?
The canonical SMILES for N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide is CCCC(=O)Nc1ccccc1NC(=O)[C@@H](C)Oc1ccccc1.
What is the InChIKey of N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide?
The InChIKey is LXEIECVJTOAHGF-CQSZACIVSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-9-18(22)20-16-12-7-8-13-17(16)21-19(23)14(2)24-15-10-5-4-6-11-15/h4-8,10-14H,3,9H2,1-2H3,(H,20,22)(H,21,23)/t14-/m1/s1.
What are the key properties of N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide?
N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide has a molecular weight of 326.40 g/mol, XLogP of 3.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[(2R)-2-phenoxypropanoyl]amino]phenyl]butanamide is sourced from PubChem (CID 1255249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).