N-butyl-N-ethyl-2-phenoxypropanamide

C15H23NO2 — CID 2915016

IUPACN-butyl-N-ethyl-2-phenoxypropanamide
SMILESCCCCN(CC)C(=O)C(C)Oc1ccccc1
InChIInChI=1S/C15H23NO2/c1-4-6-12-16(5-2)15(17)13(3)18-14-10-8-7-9-11-14/h7-11,13H,4-6,12H2,1-3H3
InChIKeyBPNXTEXRSNIOIG-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.10
Rot. Bonds7

About N-butyl-N-ethyl-2-phenoxypropanamide

N-butyl-N-ethyl-2-phenoxypropanamide (PubChem CID 2915016) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-butyl-N-ethyl-2-phenoxypropanamide.

Molecular Properties

Compound NameN-butyl-N-ethyl-2-phenoxypropanamide
PubChem CID2915016
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-butyl-N-ethyl-2-phenoxypropanamide
SMILESCCCCN(CC)C(=O)C(C)Oc1ccccc1
InChIInChI=1S/C15H23NO2/c1-4-6-12-16(5-2)15(17)13(3)18-14-10-8-7-9-11-14/h7-11,13H,4-6,12H2,1-3H3
InChIKeyBPNXTEXRSNIOIG-UHFFFAOYSA-N
XLogP3.10
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dibutyl-2-phenoxybutanamide
CID 3492483
N-ethyl-2-(4-fluorophenoxy)-N-(3-hydroxypropyl)propanamide
CID 115771406
(2S)-N-ethyl-2-phenoxy-N-phenylpropanamide
CID 670227
(2S)-2-(3-chlorophenoxy)-N,N-diethylpropanamide
CID 40538344
N,N-diethyl-2-(3-methoxyphenoxy)propanamide
CID 19203980
N-[(5-chlorothiophen-2-yl)methyl]-N-ethyl-2-phenoxypropanamide
CID 42891269
2-phenoxy-N-[2-[N-(2-phenoxypropanoyl)anilino]ethyl]-N-phenylpropanamide
CID 4940214
2-(4-tert-butylphenoxy)-N,N-diethylpropanamide
CID 19204171
2-[4-[(1S)-1-aminoethyl]phenoxy]-N,N-diethylpropanamide
CID 63367483
methyl 3-[ethyl-[2-(3-methylphenoxy)propanoyl]amino]propanoate
CID 61006680
2-[ethyl-[2-(3-propan-2-ylphenoxy)propanoyl]amino]acetic acid
CID 119206542
(2S)-N-methoxy-N-methyl-2-phenoxypropanamide
CID 95297395

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-ethyl-2-phenoxypropanamide?
The IUPAC name of N-butyl-N-ethyl-2-phenoxypropanamide (CID 2915016) is N-butyl-N-ethyl-2-phenoxypropanamide.
What is the SMILES notation for N-butyl-N-ethyl-2-phenoxypropanamide?
The canonical SMILES for N-butyl-N-ethyl-2-phenoxypropanamide is CCCCN(CC)C(=O)C(C)Oc1ccccc1.
What is the InChIKey of N-butyl-N-ethyl-2-phenoxypropanamide?
The InChIKey is BPNXTEXRSNIOIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-4-6-12-16(5-2)15(17)13(3)18-14-10-8-7-9-11-14/h7-11,13H,4-6,12H2,1-3H3.
What are the key properties of N-butyl-N-ethyl-2-phenoxypropanamide?
N-butyl-N-ethyl-2-phenoxypropanamide has a molecular weight of 249.35 g/mol, XLogP of 3.10, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethyl-2-phenoxypropanamide is sourced from PubChem (CID 2915016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).