N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide

C14H21N3O3 — CID 108899927

IUPACN-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide
SMILESCOc1ccccc1CCNC(=O)N(CCN)C(C)=O
InChIInChI=1S/C14H21N3O3/c1-11(18)17(10-8-15)14(19)16-9-7-12-5-3-4-6-13(12)20-2/h3-6H,7-10,15H2,1-2H3,(H,16,19)
InChIKeyHRRPXUGYKKEZJE-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.75
Rot. Bonds6

About N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide

N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide (PubChem CID 108899927) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide
PubChem CID108899927
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC NameN-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide
SMILESCOc1ccccc1CCNC(=O)N(CCN)C(C)=O
InChIInChI=1S/C14H21N3O3/c1-11(18)17(10-8-15)14(19)16-9-7-12-5-3-4-6-13(12)20-2/h3-6H,7-10,15H2,1-2H3,(H,16,19)
InChIKeyHRRPXUGYKKEZJE-UHFFFAOYSA-N
XLogP0.75
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminoethyl)-N-[2-(2-methylphenyl)ethylcarbamoyl]acetamide
CID 108899771
N-(4-aminophenyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide
CID 108899832
2,2,3,3,3-pentafluoro-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 584158
N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide
CID 15179102
N'-[2-(dimethylamino)ethyl]-N-[2-(2-methoxyphenyl)ethyl]oxamide
CID 44996174
(2R)-2-amino-N-[2-(2-methoxyphenyl)ethyl]propanamide;hydrochloride
CID 119270019
ethyl N-(2-aminoethyl)-N-[2-(2-fluorophenyl)ethylcarbamoyl]carbamate
CID 108900177
2-amino-N-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]acetamide
CID 103629773
3-amino-N-[2-(2-methoxyphenyl)ethyl]-2,2,3-trimethylbutanamide
CID 106260825
5-amino-N-[2-(2-methoxyphenyl)ethyl]-4-methylpentanamide
CID 106260751
3-(N-acetylanilino)-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 113123377
N-acetyl-N-[(2-methoxyphenyl)methyl]acetamide
CID 91715642

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide?
The IUPAC name of N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide (CID 108899927) is N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide?
The canonical SMILES for N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide is COc1ccccc1CCNC(=O)N(CCN)C(C)=O.
What is the InChIKey of N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide?
The InChIKey is HRRPXUGYKKEZJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-11(18)17(10-8-15)14(19)16-9-7-12-5-3-4-6-13(12)20-2/h3-6H,7-10,15H2,1-2H3,(H,16,19).
What are the key properties of N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide?
N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide has a molecular weight of 279.34 g/mol, XLogP of 0.75, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-[2-(2-methoxyphenyl)ethylcarbamoyl]acetamide is sourced from PubChem (CID 108899927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).