N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide

C14H20N2O2 — CID 43136742

IUPACN-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide
SMILESNCCCN(C(=O)COc1ccccc1)C1CC1
InChIInChI=1S/C14H20N2O2/c15-9-4-10-16(12-7-8-12)14(17)11-18-13-5-2-1-3-6-13/h1-3,5-6,12H,4,7-11,15H2
InChIKeyKLBNLEXRCURFJG-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.41
Rot. Bonds7

About N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide

N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide (PubChem CID 43136742) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide
PubChem CID43136742
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide
SMILESNCCCN(C(=O)COc1ccccc1)C1CC1
InChIInChI=1S/C14H20N2O2/c15-9-4-10-16(12-7-8-12)14(17)11-18-13-5-2-1-3-6-13/h1-3,5-6,12H,4,7-11,15H2
InChIKeyKLBNLEXRCURFJG-UHFFFAOYSA-N
XLogP1.41
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-N-cyclohexyl-2-phenoxyacetamide
CID 43319389
N-(2-chloroethyl)-N-cyclobutyl-2-phenoxyacetamide
CID 102872589
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenoxyacetamide
CID 102684381
N-(3-aminopropyl)-2-phenoxy-N-phenylacetamide
CID 28766720
N-(3-aminopropyl)-N-cyclopropyl-2-(2-hydroxyphenyl)acetamide
CID 80744348
N-(3-aminopropyl)-N-benzyl-2-phenoxyacetamide;hydrochloride
CID 120649017
N-(3-aminopropyl)-N-cyclopropyl-2-(2-fluorophenyl)acetamide
CID 43136756
N-(3-aminopropyl)-N-cyclobutyl-3-phenylpropanamide
CID 102873861
N-(4-aminobutyl)-N-ethyl-2-phenoxyacetamide
CID 83969246
2-(2-aminophenoxy)-N-butyl-N-cyclopropylacetamide
CID 61106387
2-(4-bromophenoxy)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide
CID 102866038
2-(3-chlorophenoxy)-N-(3-chloropropyl)-N-cyclobutylacetamide
CID 102872110

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide?
The IUPAC name of N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide (CID 43136742) is N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide?
The canonical SMILES for N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide is NCCCN(C(=O)COc1ccccc1)C1CC1.
What is the InChIKey of N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide?
The InChIKey is KLBNLEXRCURFJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c15-9-4-10-16(12-7-8-12)14(17)11-18-13-5-2-1-3-6-13/h1-3,5-6,12H,4,7-11,15H2.
What are the key properties of N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide?
N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.41, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cyclopropyl-2-phenoxyacetamide is sourced from PubChem (CID 43136742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).