2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide

C19H22ClNO3 — CID 53284308

IUPAC2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide
SMILESCCC(Oc1ccccc1Cl)C(=O)Nc1ccccc1OC(C)C
InChIInChI=1S/C19H22ClNO3/c1-4-16(24-17-11-7-5-9-14(17)20)19(22)21-15-10-6-8-12-18(15)23-13(2)3/h5-13,16H,4H2,1-3H3,(H,21,22)
InChIKeyFLLLGEZYFPELGT-UHFFFAOYSA-N
MW347.84 g/mol
LogP4.92
Rot. Bonds7

About 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide

2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide (PubChem CID 53284308) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide
PubChem CID53284308
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC Name2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide
SMILESCCC(Oc1ccccc1Cl)C(=O)Nc1ccccc1OC(C)C
InChIInChI=1S/C19H22ClNO3/c1-4-16(24-17-11-7-5-9-14(17)20)19(22)21-15-10-6-8-12-18(15)23-13(2)3/h5-13,16H,4H2,1-3H3,(H,21,22)
InChIKeyFLLLGEZYFPELGT-UHFFFAOYSA-N
XLogP4.92
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(2-chlorophenoxy)-N-(2,4,5-trichlorophenyl)butanamide
CID 28573433
(2S)-2-(2-chlorophenoxy)-N-(2,4,5-trichlorophenyl)butanamide
CID 28573436
2-[2-(2-chlorophenoxy)butanoylamino]benzamide
CID 53284900
(2R)-2-(2-chlorophenoxy)-N-(4-propan-2-ylphenyl)butanamide
CID 94027219
(2R)-N-[(2S)-butan-2-yl]-2-(2-chlorophenoxy)butanamide
CID 38013268
(2R)-2-(2-chlorophenoxy)-N-(2,4-dimethylphenyl)butanamide
CID 30396975
methyl 3-[[(2R)-2-(2-chlorophenoxy)butanoyl]amino]-2-methylbenzoate
CID 92677984
(2R)-N-(2-chlorophenyl)-2-naphthalen-1-yloxybutanamide
CID 94019163
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(2-chlorophenoxy)butanamide
CID 30384530
(2S)-N-(2,3-dichlorophenyl)-2-(2-methoxyphenoxy)butanamide
CID 9173593
(2R)-2-(2-chlorophenoxy)-N-(4-iodo-2-methylphenyl)butanamide
CID 92647108
2-(2-butan-2-ylphenoxy)-N-(2,3-dichlorophenyl)butanamide
CID 17150644

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide (CID 53284308) is 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide is CCC(Oc1ccccc1Cl)C(=O)Nc1ccccc1OC(C)C.
What is the InChIKey of 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide?
The InChIKey is FLLLGEZYFPELGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-4-16(24-17-11-7-5-9-14(17)20)19(22)21-15-10-6-8-12-18(15)23-13(2)3/h5-13,16H,4H2,1-3H3,(H,21,22).
What are the key properties of 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide?
2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide has a molecular weight of 347.84 g/mol, XLogP of 4.92, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide is sourced from PubChem (CID 53284308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).