N-butan-2-yl-4-(4-methoxyphenoxy)butanamide

C15H23NO3 — CID 19175097

IUPACN-butan-2-yl-4-(4-methoxyphenoxy)butanamide
SMILESCCC(C)NC(=O)CCCOc1ccc(OC)cc1
InChIInChI=1S/C15H23NO3/c1-4-12(2)16-15(17)6-5-11-19-14-9-7-13(18-3)8-10-14/h7-10,12H,4-6,11H2,1-3H3,(H,16,17)
InChIKeyRXDZKIPTRDFRGU-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.77
Rot. Bonds8

About N-butan-2-yl-4-(4-methoxyphenoxy)butanamide

N-butan-2-yl-4-(4-methoxyphenoxy)butanamide (PubChem CID 19175097) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-butan-2-yl-4-(4-methoxyphenoxy)butanamide.

Molecular Properties

Compound NameN-butan-2-yl-4-(4-methoxyphenoxy)butanamide
PubChem CID19175097
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-butan-2-yl-4-(4-methoxyphenoxy)butanamide
SMILESCCC(C)NC(=O)CCCOc1ccc(OC)cc1
InChIInChI=1S/C15H23NO3/c1-4-12(2)16-15(17)6-5-11-19-14-9-7-13(18-3)8-10-14/h7-10,12H,4-6,11H2,1-3H3,(H,16,17)
InChIKeyRXDZKIPTRDFRGU-UHFFFAOYSA-N
XLogP2.77
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butan-2-yl-3-(4-methoxyphenyl)propanamide
CID 4681975
N-ethyl-4-(4-methoxyphenoxy)butanamide
CID 21173657
2-[acetyl-[2-(4-methoxyphenoxy)ethyl]amino]-N-butan-2-ylacetamide
CID 113165945
4-(3-bromophenoxy)-N-butan-2-ylbutanamide
CID 112759657
N-butan-2-yl-4-oxo-4-(4-propoxyphenyl)butanamide
CID 78773838
N-[(2S)-1-[[(2R)-butan-2-yl]amino]-1-oxopropan-2-yl]-4-(4-methoxyphenoxy)-N-[(4-methoxyphenyl)methyl]butanamide
CID 100618177
N-(2-aminopropyl)-4-(4-methoxyphenoxy)butanamide
CID 82354195
N-[2-[2-[2-[2-[3-(butan-2-ylamino)-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]-4-(4-methoxyphenyl)butanamide
CID 171843476
N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-4-(4-methoxyphenoxy)butanamide
CID 93487568
N-[1-(2,4-dimethylphenyl)ethyl]-4-(4-methoxyphenoxy)butanamide
CID 43909491
1-butan-2-yl-2-[3-(4-methoxyphenoxy)propyl]guanidine
CID 110921001
[2-oxo-2-(propan-2-ylamino)ethyl] 4-(4-methoxyphenoxy)butanoate
CID 7147025

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-4-(4-methoxyphenoxy)butanamide?
The IUPAC name of N-butan-2-yl-4-(4-methoxyphenoxy)butanamide (CID 19175097) is N-butan-2-yl-4-(4-methoxyphenoxy)butanamide.
What is the SMILES notation for N-butan-2-yl-4-(4-methoxyphenoxy)butanamide?
The canonical SMILES for N-butan-2-yl-4-(4-methoxyphenoxy)butanamide is CCC(C)NC(=O)CCCOc1ccc(OC)cc1.
What is the InChIKey of N-butan-2-yl-4-(4-methoxyphenoxy)butanamide?
The InChIKey is RXDZKIPTRDFRGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-4-12(2)16-15(17)6-5-11-19-14-9-7-13(18-3)8-10-14/h7-10,12H,4-6,11H2,1-3H3,(H,16,17).
What are the key properties of N-butan-2-yl-4-(4-methoxyphenoxy)butanamide?
N-butan-2-yl-4-(4-methoxyphenoxy)butanamide has a molecular weight of 265.35 g/mol, XLogP of 2.77, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-4-(4-methoxyphenoxy)butanamide is sourced from PubChem (CID 19175097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).