N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide

C17H26N2O2 — CID 119567203

IUPACN-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)NC2(CN)CCCC2)c(C)c1
InChIInChI=1S/C17H26N2O2/c1-12-8-13(2)16(14(3)9-12)21-10-15(20)19-17(11-18)6-4-5-7-17/h8-9H,4-7,10-11,18H2,1-3H3,(H,19,20)
InChIKeyAPWUHDOAYRAJSE-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.38
Rot. Bonds5

About N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide

N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide (PubChem CID 119567203) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide
PubChem CID119567203
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide
SMILESCc1cc(C)c(OCC(=O)NC2(CN)CCCC2)c(C)c1
InChIInChI=1S/C17H26N2O2/c1-12-8-13(2)16(14(3)9-12)21-10-15(20)19-17(11-18)6-4-5-7-17/h8-9H,4-7,10-11,18H2,1-3H3,(H,19,20)
InChIKeyAPWUHDOAYRAJSE-UHFFFAOYSA-N
XLogP2.38
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(hydroxymethyl)cyclobutyl]-2-(2,4,6-trimethylphenoxy)acetamide
CID 115878097
N-[1-(aminomethyl)cyclopentyl]-2-(3,4-dimethylphenoxy)acetamide
CID 119565775
N-[1-(aminomethyl)cyclopentyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 119567192
2-(2,6-dimethylphenoxy)-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62517015
N-[1-(aminomethyl)cyclohexyl]-2-methoxyacetamide
CID 63755662
N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide
CID 63755837
N-[1-(aminomethyl)cyclopentyl]-3-(2,4-dimethylphenyl)propanamide;hydrochloride
CID 119565360
N-[1-(aminomethyl)cyclopentyl]-3-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide;hydrochloride
CID 119565883
N-[1-(aminomethyl)cyclopentyl]-2-(4-iodophenoxy)acetamide;hydrochloride
CID 119567396
N-[1-(aminomethyl)cyclopentyl]-2-propan-2-yloxyacetamide
CID 112701354
N-cycloheptyl-2-(2,4,6-trimethylphenoxy)acetamide
CID 9218083
N-[2-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide;hydrochloride
CID 119603633

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide (CID 119567203) is N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide is Cc1cc(C)c(OCC(=O)NC2(CN)CCCC2)c(C)c1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide?
The InChIKey is APWUHDOAYRAJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-12-8-13(2)16(14(3)9-12)21-10-15(20)19-17(11-18)6-4-5-7-17/h8-9H,4-7,10-11,18H2,1-3H3,(H,19,20).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide?
N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide has a molecular weight of 290.41 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-2-(2,4,6-trimethylphenoxy)acetamide is sourced from PubChem (CID 119567203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).