N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide

C17H26N2O2 — CID 62628087

IUPACN-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide
SMILESCCNC(C)c1cc(C)ccc1OCCC(=O)NC1CC1
InChIInChI=1S/C17H26N2O2/c1-4-18-13(3)15-11-12(2)5-8-16(15)21-10-9-17(20)19-14-6-7-14/h5,8,11,13-14,18H,4,6-7,9-10H2,1-3H3,(H,19,20)
InChIKeyUFHOGZHZLCNEHO-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.71
Rot. Bonds8

About N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide

N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide (PubChem CID 62628087) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide
PubChem CID62628087
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide
SMILESCCNC(C)c1cc(C)ccc1OCCC(=O)NC1CC1
InChIInChI=1S/C17H26N2O2/c1-4-18-13(3)15-11-12(2)5-8-16(15)21-10-9-17(20)19-14-6-7-14/h5,8,11,13-14,18H,4,6-7,9-10H2,1-3H3,(H,19,20)
InChIKeyUFHOGZHZLCNEHO-UHFFFAOYSA-N
XLogP2.71
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-[4-methyl-2-[1-(methylamino)ethyl]phenoxy]propanamide
CID 62628086
N-cyclopropyl-2-[4-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide
CID 43505232
N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine
CID 43505142
N-cyclopropyl-3-(2-fluoro-5-methylphenoxy)propanamide
CID 64853538
1-(2-butoxy-5-methylphenyl)-N-ethylethanamine
CID 43505150
3-[2-(2-aminobutyl)-4-methylphenoxy]-N-cyclopropylpropanamide
CID 63326041
N-ethyl-1-(2-hexoxy-5-methylphenyl)ethanamine
CID 43505152
N-cyclopentyl-2-[2-[(1R)-1-hydroxyethyl]-4-methylphenoxy]acetamide
CID 63366475
3-[2-[1-(ethylamino)ethyl]-5-methylphenoxy]-N,N-dimethylpropanamide
CID 63640822
1-[2-(cyclopentylmethoxy)-5-methylphenyl]-N-ethylethanamine
CID 61344981
N-cyclopropyl-2-[5-methyl-2-[1-(methylamino)ethyl]phenoxy]acetamide
CID 63639605
2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide
CID 62074242

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide?
The IUPAC name of N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide (CID 62628087) is N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide?
The canonical SMILES for N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide is CCNC(C)c1cc(C)ccc1OCCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide?
The InChIKey is UFHOGZHZLCNEHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-18-13(3)15-11-12(2)5-8-16(15)21-10-9-17(20)19-14-6-7-14/h5,8,11,13-14,18H,4,6-7,9-10H2,1-3H3,(H,19,20).
What are the key properties of N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide?
N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.71, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide is sourced from PubChem (CID 62628087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).