N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide

C14H20N2O2 — CID 43276024

IUPACN-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide
SMILESCCOCC(=O)N(c1ccc(CN)cc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-18-10-14(17)16(13-7-8-13)12-5-3-11(9-15)4-6-12/h3-6,13H,2,7-10,15H2,1H3
InChIKeyWJANRGJBJIWZAU-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.68
Rot. Bonds6

About N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide

N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide (PubChem CID 43276024) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide
PubChem CID43276024
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide
SMILESCCOCC(=O)N(c1ccc(CN)cc1)C1CC1
InChIInChI=1S/C14H20N2O2/c1-2-18-10-14(17)16(13-7-8-13)12-5-3-11(9-15)4-6-12/h3-6,13H,2,7-10,15H2,1H3
InChIKeyWJANRGJBJIWZAU-UHFFFAOYSA-N
XLogP1.68
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(2,2,2-trifluoroethoxy)acetamide
CID 103205396
ethyl N-[4-(aminomethyl)phenyl]-N-cyclopropylcarbamate
CID 43276107
N-[4-(aminomethyl)phenyl]-2-ethoxy-N-methylacetamide
CID 43275430
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-(1-methoxycyclobutyl)acetamide
CID 103555309
phenyl N-[4-(aminomethyl)phenyl]-N-cyclopropylcarbamate
CID 43276104
2-[4-(aminomethyl)phenoxy]-N-cyclopropyl-N-ethylacetamide
CID 43263738
2-[4-(aminomethyl)-N-cyclopropylanilino]-N,N-diethylacetamide
CID 43276216
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-6-methylpyridine-2-carboxamide
CID 43276034
N-[4-(aminomethyl)phenyl]-N-cyclopropyloxolane-3-carboxamide
CID 61271794
N-[4-(aminomethyl)phenyl]-N-cyclopropyloxolane-2-carboxamide
CID 43276045
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-1-methylimidazole-4-carboxamide
CID 107970828
N-[4-(aminomethyl)phenyl]-N-cyclopropylpyridine-2-carboxamide
CID 43276062

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide (CID 43276024) is N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide is CCOCC(=O)N(c1ccc(CN)cc1)C1CC1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide?
The InChIKey is WJANRGJBJIWZAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-18-10-14(17)16(13-7-8-13)12-5-3-11(9-15)4-6-12/h3-6,13H,2,7-10,15H2,1H3.
What are the key properties of N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide?
N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-N-cyclopropyl-2-ethoxyacetamide is sourced from PubChem (CID 43276024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).