N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide

C15H24N2O2 — CID 43254471

IUPACN-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide
SMILESCCc1ccccc1OCCC(=O)N(C)CCCN
InChIInChI=1S/C15H24N2O2/c1-3-13-7-4-5-8-14(13)19-12-9-15(18)17(2)11-6-10-16/h4-5,7-8H,3,6,9-12,16H2,1-2H3
InChIKeyZVRCFSIRCYZWDE-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.83
Rot. Bonds8

About N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide

N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide (PubChem CID 43254471) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide
PubChem CID43254471
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide
SMILESCCc1ccccc1OCCC(=O)N(C)CCCN
InChIInChI=1S/C15H24N2O2/c1-3-13-7-4-5-8-14(13)19-12-9-15(18)17(2)11-6-10-16/h4-5,7-8H,3,6,9-12,16H2,1-2H3
InChIKeyZVRCFSIRCYZWDE-UHFFFAOYSA-N
XLogP1.83
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-[3-(2-ethylphenoxy)propyl]-N-methylhexanamide
CID 142014071
4-(2-ethylphenoxy)butanamide
CID 82040636
N-(3-aminopropyl)-3-(4-ethylphenoxy)-N-methylpropanamide
CID 43254052
N-(5-aminopentyl)-N-methyl-3-phenoxypropanamide
CID 107206604
N-(3-aminopropyl)-3-[(2-fluorophenyl)methoxy]-N-methylpropanamide
CID 63934653
N-(3-aminopropyl)-N-methyl-3-quinolin-8-yloxypropanamide
CID 43254317
N-(3-aminopropyl)-N-methyl-3-quinolin-5-yloxypropanamide
CID 103044350
3-[3-(2-ethylphenoxy)propoxy]propan-1-amine
CID 82353346
3-amino-N-methyl-N-(3-phenoxypropyl)propanamide;hydrochloride
CID 119294025
3-(2-aminophenyl)-N-methyl-N-[3-(2-methylphenoxy)propyl]propanamide;hydrochloride
CID 120609501
N-[[2-(3-aminopropoxy)phenyl]methyl]-N-methylbutan-1-amine
CID 162214464
5-(2-ethylphenoxy)pentanoic acid
CID 43351498

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide?
The IUPAC name of N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide (CID 43254471) is N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide.
What is the SMILES notation for N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide?
The canonical SMILES for N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide is CCc1ccccc1OCCC(=O)N(C)CCCN.
What is the InChIKey of N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide?
The InChIKey is ZVRCFSIRCYZWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-13-7-4-5-8-14(13)19-12-9-15(18)17(2)11-6-10-16/h4-5,7-8H,3,6,9-12,16H2,1-2H3.
What are the key properties of N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide?
N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 1.83, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-3-(2-ethylphenoxy)-N-methylpropanamide is sourced from PubChem (CID 43254471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).