2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide

C17H28N2O2 — CID 43279779

IUPAC2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide
SMILESCCNC(C)CCc1ccc(OC(C)C(=O)N(C)C)cc1
InChIInChI=1S/C17H28N2O2/c1-6-18-13(2)7-8-15-9-11-16(12-10-15)21-14(3)17(20)19(4)5/h9-14,18H,6-8H2,1-5H3
InChIKeyGGSFRXWMGRUVKC-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.47
Rot. Bonds8

About 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide

2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide (PubChem CID 43279779) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide
PubChem CID43279779
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide
SMILESCCNC(C)CCc1ccc(OC(C)C(=O)N(C)C)cc1
InChIInChI=1S/C17H28N2O2/c1-6-18-13(2)7-8-15-9-11-16(12-10-15)21-14(3)17(20)19(4)5/h9-14,18H,6-8H2,1-5H3
InChIKeyGGSFRXWMGRUVKC-UHFFFAOYSA-N
XLogP2.47
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-[4-(3-oxobutyl)phenoxy]propanamide
CID 43085576
4-(4-ethoxyphenyl)-N-ethylbutan-2-amine
CID 43279773
2-[4-[(tert-butylamino)methyl]phenoxy]-N,N-dimethylpropanamide
CID 63062524
N,N-dimethyl-2-(4-propanoylphenoxy)propanamide
CID 43085562
2-[4-[3-(ethylamino)butyl]phenoxy]-N-propylacetamide
CID 43279784
methyl 4-[4-[3-(ethylamino)butyl]phenoxy]butanoate
CID 60881948
4-[4-[3-(ethylamino)butyl]phenoxy]-N-methylbutanamide
CID 63892865
2-[4-(1-hydroxypropyl)phenoxy]-N,N-dimethylpropanamide
CID 43504470
2-[4-[4-(difluoromethoxy)phenyl]butan-2-ylamino]acetic acid
CID 43247467
4-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]oxybenzoic acid
CID 40895940
3-[2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-1,1-dimethylurea
CID 83107943
(2R)-2-(4-propylphenoxy)propanoyl chloride
CID 86712374

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide?
The IUPAC name of 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide (CID 43279779) is 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide is CCNC(C)CCc1ccc(OC(C)C(=O)N(C)C)cc1.
What is the InChIKey of 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide?
The InChIKey is GGSFRXWMGRUVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-6-18-13(2)7-8-15-9-11-16(12-10-15)21-14(3)17(20)19(4)5/h9-14,18H,6-8H2,1-5H3.
What are the key properties of 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide?
2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide has a molecular weight of 292.42 g/mol, XLogP of 2.47, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(ethylamino)butyl]phenoxy]-N,N-dimethylpropanamide is sourced from PubChem (CID 43279779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).