3-[4-[1-(ethylamino)propyl]phenoxy]propanamide

C14H22N2O2 — CID 43280110

IUPAC3-[4-[1-(ethylamino)propyl]phenoxy]propanamide
SMILESCCNC(CC)c1ccc(OCCC(N)=O)cc1
InChIInChI=1S/C14H22N2O2/c1-3-13(16-4-2)11-5-7-12(8-6-11)18-10-9-14(15)17/h5-8,13,16H,3-4,9-10H2,1-2H3,(H2,15,17)
InChIKeyHUNRIWYCUBZVOW-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.00
Rot. Bonds8

About 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide

3-[4-[1-(ethylamino)propyl]phenoxy]propanamide (PubChem CID 43280110) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide.

Molecular Properties

Compound Name3-[4-[1-(ethylamino)propyl]phenoxy]propanamide
PubChem CID43280110
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-[4-[1-(ethylamino)propyl]phenoxy]propanamide
SMILESCCNC(CC)c1ccc(OCCC(N)=O)cc1
InChIInChI=1S/C14H22N2O2/c1-3-13(16-4-2)11-5-7-12(8-6-11)18-10-9-14(15)17/h5-8,13,16H,3-4,9-10H2,1-2H3,(H2,15,17)
InChIKeyHUNRIWYCUBZVOW-UHFFFAOYSA-N
XLogP2.00
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-[(1S)-1-hydroxypropyl]phenoxy]propanamide
CID 78932628
N-ethyl-1-(4-hexoxyphenyl)propan-1-amine
CID 43280119
3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 78930528
N-ethyl-1-[4-(2-methylsulfonylethoxy)phenyl]propan-1-amine
CID 54936865
N-ethyl-2-[4-[1-(ethylamino)propyl]phenoxy]acetamide
CID 43280159
N-ethyl-1-[4-(2-phenylethoxy)phenyl]propan-1-amine
CID 43280157
methyl 4-[4-[1-(methylamino)propyl]phenoxy]butanoate
CID 60889536
N-ethyl-1-[4-(2-morpholin-4-ylethoxy)phenyl]propan-1-amine
CID 60888208
N-ethyl-1-(4-phenoxyphenyl)propan-1-amine
CID 43489604
1-(4-pentoxyphenyl)-N-propylpropan-1-amine
CID 43280171
N-ethyl-1-(4-propoxyphenyl)pentan-1-amine
CID 79405246
1-(4-butoxyphenyl)-N-ethylheptan-1-amine
CID 105125826

Frequently Asked Questions

What is the IUPAC name of 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide?
The IUPAC name of 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide (CID 43280110) is 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide.
What is the SMILES notation for 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide?
The canonical SMILES for 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide is CCNC(CC)c1ccc(OCCC(N)=O)cc1.
What is the InChIKey of 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide?
The InChIKey is HUNRIWYCUBZVOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-13(16-4-2)11-5-7-12(8-6-11)18-10-9-14(15)17/h5-8,13,16H,3-4,9-10H2,1-2H3,(H2,15,17).
What are the key properties of 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide?
3-[4-[1-(ethylamino)propyl]phenoxy]propanamide has a molecular weight of 250.34 g/mol, XLogP of 2.00, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[1-(ethylamino)propyl]phenoxy]propanamide is sourced from PubChem (CID 43280110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).