N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide

C19H22N2O3 — CID 7868582

IUPACN-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide
SMILESCC[C@@H](C)NC(=O)NC(=O)COc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-3-14(2)20-19(23)21-18(22)13-24-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12,14H,3,13H2,1-2H3,(H2,20,21,22,23)/t14-/m1/s1
InChIKeyAPTYVMKMTYVDNB-CQSZACIVSA-N
MW326.40 g/mol
LogP3.36
Rot. Bonds6

About N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide

N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide (PubChem CID 7868582) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide
PubChem CID7868582
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide
SMILESCC[C@@H](C)NC(=O)NC(=O)COc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H22N2O3/c1-3-14(2)20-19(23)21-18(22)13-24-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12,14H,3,13H2,1-2H3,(H2,20,21,22,23)/t14-/m1/s1
InChIKeyAPTYVMKMTYVDNB-CQSZACIVSA-N
XLogP3.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(2S)-butan-2-yl]carbamoyl]-2-(4-methylphenoxy)acetamide
CID 7817259
2-(4-acetylphenoxy)-N-[[(2S)-butan-2-yl]carbamoyl]acetamide
CID 7763913
N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-tert-butylphenoxy)acetamide
CID 8009528
[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] 2-(4-benzoylphenoxy)acetate
CID 8925625
N-[(2R)-butan-2-yl]-2-(4-phenoxyphenoxy)acetamide
CID 7611072
N-[[(2R)-butan-2-yl]carbamoyl]-2-(3-cyanophenoxy)acetamide
CID 7964489
[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl]-methyl-(2-phenoxyethyl)azanium
CID 8797396
N-carbamoyl-2-(4-phenylphenoxy)acetamide
CID 7868557
[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] (2S)-2-hydroxy-2-phenylacetate
CID 7834280
N-[[(2S)-butan-2-yl]carbamoyl]-2-(2-nitrophenoxy)acetamide
CID 7819293
N-[[(2R)-butan-2-yl]carbamoyl]-2-(2,3-dichlorophenoxy)acetamide
CID 8604340
[2-[[(2R)-butan-2-yl]carbamoylamino]-2-oxoethyl] (2R)-2-phenylsulfanylpropanoate
CID 7806754

Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide?
The IUPAC name of N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide (CID 7868582) is N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide.
What is the SMILES notation for N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide?
The canonical SMILES for N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide is CC[C@@H](C)NC(=O)NC(=O)COc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide?
The InChIKey is APTYVMKMTYVDNB-CQSZACIVSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-14(2)20-19(23)21-18(22)13-24-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12,14H,3,13H2,1-2H3,(H2,20,21,22,23)/t14-/m1/s1.
What are the key properties of N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide?
N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide has a molecular weight of 326.40 g/mol, XLogP of 3.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-butan-2-yl]carbamoyl]-2-(4-phenylphenoxy)acetamide is sourced from PubChem (CID 7868582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).