2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide

C19H22ClNO3 — CID 132652829

IUPAC2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide
SMILESCc1cc(OC(C)C(=O)Nc2cccc(OC(C)C)c2)ccc1Cl
InChIInChI=1S/C19H22ClNO3/c1-12(2)23-16-7-5-6-15(11-16)21-19(22)14(4)24-17-8-9-18(20)13(3)10-17/h5-12,14H,1-4H3,(H,21,22)
InChIKeyGXZFQDGLAFRPRA-UHFFFAOYSA-N
MW347.84 g/mol
LogP4.84
Rot. Bonds6

About 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide

2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide (PubChem CID 132652829) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide.

Molecular Properties

Compound Name2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide
PubChem CID132652829
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC Name2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide
SMILESCc1cc(OC(C)C(=O)Nc2cccc(OC(C)C)c2)ccc1Cl
InChIInChI=1S/C19H22ClNO3/c1-12(2)23-16-7-5-6-15(11-16)21-19(22)14(4)24-17-8-9-18(20)13(3)10-17/h5-12,14H,1-4H3,(H,21,22)
InChIKeyGXZFQDGLAFRPRA-UHFFFAOYSA-N
XLogP4.84
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chloro-3-methylphenoxy)-N-(3-fluorophenyl)propanamide
CID 53265982
2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)butanamide
CID 132654423
3-[2-(4-chloro-3-methylphenoxy)propanoylamino]benzamide
CID 53288806
2-(4-chloro-3-methylphenoxy)-N-(3,4-dichlorophenyl)propanamide
CID 53265973
2-(2-chlorophenoxy)-N-(3-propan-2-yloxyphenyl)propanamide
CID 17154741
(2R)-2-(4-chloro-3-methylphenoxy)-N-(2,6-dimethylphenyl)propanamide
CID 26542487
(2S)-2-(4-chloro-3-methylphenoxy)-N-[(3-propan-2-yloxyphenyl)methyl]propanamide
CID 99132987
2-(4-chloro-3-methylphenoxy)-N-(4-iodophenyl)propanamide
CID 53265997
(2S)-2-(2,3-dimethylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide
CID 38013113
(2S)-2-(4-chloro-3-methylphenoxy)-N-(3,4-dimethoxyphenyl)propanamide
CID 26802583
(2S)-N-(3,4-dichlorophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 95077681
(2R)-2-(3-chlorophenoxy)-N-(3-chlorophenyl)propanamide
CID 966245

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide?
The IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide (CID 132652829) is 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide.
What is the SMILES notation for 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide?
The canonical SMILES for 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide is Cc1cc(OC(C)C(=O)Nc2cccc(OC(C)C)c2)ccc1Cl.
What is the InChIKey of 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide?
The InChIKey is GXZFQDGLAFRPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-12(2)23-16-7-5-6-15(11-16)21-19(22)14(4)24-17-8-9-18(20)13(3)10-17/h5-12,14H,1-4H3,(H,21,22).
What are the key properties of 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide?
2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide has a molecular weight of 347.84 g/mol, XLogP of 4.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-methylphenoxy)-N-(3-propan-2-yloxyphenyl)propanamide is sourced from PubChem (CID 132652829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).