2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide

C20H25NO3 — CID 4943144

IUPAC2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide
SMILESCCCOc1ccc(NC(=O)C(CC)Oc2cccc(C)c2)cc1
InChIInChI=1S/C20H25NO3/c1-4-13-23-17-11-9-16(10-12-17)21-20(22)19(5-2)24-18-8-6-7-15(3)14-18/h6-12,14,19H,4-5,13H2,1-3H3,(H,21,22)
InChIKeyUUGIOFGMQGYNPC-UHFFFAOYSA-N
MW327.42 g/mol
LogP4.58
Rot. Bonds8

About 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide

2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide (PubChem CID 4943144) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide
PubChem CID4943144
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide
SMILESCCCOc1ccc(NC(=O)C(CC)Oc2cccc(C)c2)cc1
InChIInChI=1S/C20H25NO3/c1-4-13-23-17-11-9-16(10-12-17)21-20(22)19(5-2)24-18-8-6-7-15(3)14-18/h6-12,14,19H,4-5,13H2,1-3H3,(H,21,22)
InChIKeyUUGIOFGMQGYNPC-UHFFFAOYSA-N
XLogP4.58
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-heptoxyphenyl)-2-(3-methylphenoxy)butanamide
CID 4951568
2-(3-methylphenoxy)-N-[4-[4-[2-(3-methylphenoxy)butanoylamino]phenoxy]phenyl]butanamide
CID 4929418
(2R)-2-(3-methylphenoxy)-N-[4-(propanoylamino)phenyl]butanamide
CID 42579556
(2S)-2-(3-methylphenoxy)-N-[4-(propanoylamino)phenyl]butanamide
CID 42579555
(2S)-2-phenoxy-N-[4-(2-phenoxyethoxy)phenyl]butanamide
CID 9296848
N-[4-[2-(3-methylphenoxy)butanoylamino]phenyl]benzamide
CID 17235402
N-(3,4-difluorophenyl)-2-(3-methylphenoxy)butanamide
CID 43905460
2-(3-methylphenoxy)-N-[3-(2-methylpropanoylamino)phenyl]butanamide
CID 17189216
(2R)-N-[4-(diethylaminomethyl)phenyl]-2-(3-methylphenoxy)butanamide
CID 99954912
2-(4-phenylphenoxy)-N-(3-propoxyphenyl)butanamide
CID 17096805
2-(3-methylphenoxy)-N-[4-(pyridin-4-ylmethyl)phenyl]butanamide
CID 133239925
(2R)-N-(4-ethoxyphenyl)-2-(3-methoxyphenoxy)butanamide
CID 92679130

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide?
The IUPAC name of 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide (CID 4943144) is 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide is CCCOc1ccc(NC(=O)C(CC)Oc2cccc(C)c2)cc1.
What is the InChIKey of 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide?
The InChIKey is UUGIOFGMQGYNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-4-13-23-17-11-9-16(10-12-17)21-20(22)19(5-2)24-18-8-6-7-15(3)14-18/h6-12,14,19H,4-5,13H2,1-3H3,(H,21,22).
What are the key properties of 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide?
2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide has a molecular weight of 327.42 g/mol, XLogP of 4.58, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-(4-propoxyphenyl)butanamide is sourced from PubChem (CID 4943144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).