2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide

C15H22N2O2 — CID 103808810

IUPAC2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)CC2(N)CCC2)c1
InChIInChI=1S/C15H22N2O2/c1-19-13-5-2-4-12(10-13)6-9-17-14(18)11-15(16)7-3-8-15/h2,4-5,10H,3,6-9,11,16H2,1H3,(H,17,18)
InChIKeyTZQYBXPOEIMILB-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.63
Rot. Bonds6

About 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide

2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide (PubChem CID 103808810) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
PubChem CID103808810
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)CC2(N)CCC2)c1
InChIInChI=1S/C15H22N2O2/c1-19-13-5-2-4-12(10-13)6-9-17-14(18)11-15(16)7-3-8-15/h2,4-5,10H,3,6-9,11,16H2,1H3,(H,17,18)
InChIKeyTZQYBXPOEIMILB-UHFFFAOYSA-N
XLogP1.63
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-aminocyclohexyl)-N-[2-(3-methylphenyl)ethyl]acetamide
CID 64679676
1-amino-N-[2-(3-methoxyphenyl)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119711038
2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352
2-hydroxy-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 94681482
1-(hydroxymethyl)-N-[2-(3-methoxyphenyl)ethyl]cyclobutane-1-carboxamide
CID 115184171
2-(1-hydroxycyclohexyl)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 111537902
2-(3-aminophenyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 28711957
N-[2-(3-methoxyphenyl)ethyl]-4-(methylamino)butanamide
CID 113266225
methyl N-[2-[2-(3-methoxyphenyl)ethylamino]-2-oxoethyl]carbamate
CID 47308059
1-[2-(3-methoxyphenyl)ethylcarbamoylamino]cyclopentane-1-carboxamide
CID 119074312
1-amino-N-[3-(3-methoxyphenyl)propyl]cyclopropane-1-carboxamide
CID 119772031
1-amino-N-[3-(3-methoxyphenyl)propyl]cyclohexane-1-carboxamide
CID 119316887

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide (CID 103808810) is 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide is COc1cccc(CCNC(=O)CC2(N)CCC2)c1.
What is the InChIKey of 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The InChIKey is TZQYBXPOEIMILB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-19-13-5-2-4-12(10-13)6-9-17-14(18)11-15(16)7-3-8-15/h2,4-5,10H,3,6-9,11,16H2,1H3,(H,17,18).
What are the key properties of 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclobutyl)-N-[2-(3-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 103808810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).