2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide

C16H24N2O3 — CID 61268519

IUPAC2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide
SMILESCOc1ccc(CN)c(OC(C)C(=O)NC2CCCC2)c1
InChIInChI=1S/C16H24N2O3/c1-11(16(19)18-13-5-3-4-6-13)21-15-9-14(20-2)8-7-12(15)10-17/h7-9,11,13H,3-6,10,17H2,1-2H3,(H,18,19)
InChIKeyNQYQIQTYWBEFSH-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.98
Rot. Bonds6

About 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide

2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide (PubChem CID 61268519) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide
PubChem CID61268519
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide
SMILESCOc1ccc(CN)c(OC(C)C(=O)NC2CCCC2)c1
InChIInChI=1S/C16H24N2O3/c1-11(16(19)18-13-5-3-4-6-13)21-15-9-14(20-2)8-7-12(15)10-17/h7-9,11,13H,3-6,10,17H2,1-2H3,(H,18,19)
InChIKeyNQYQIQTYWBEFSH-UHFFFAOYSA-N
XLogP1.98
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)-5-propoxyphenoxy]-N-cyclopropylpropanamide
CID 43472100
2-[2-(aminomethyl)-5-methoxyphenoxy]-N-ethylpropanamide
CID 61269246
2-[2-(aminomethyl)-5-methoxyphenoxy]propanamide
CID 61269245
2-[2-(aminomethyl)-4-fluorophenoxy]-N-cyclopentylpropanamide
CID 107694934
(2S)-N-cycloheptyl-2-(7-methoxynaphthalen-2-yl)oxypropanamide
CID 40855971
2-(2-acetyl-5-methoxyphenoxy)-N-cyclopropylpropanamide
CID 78906259
N-cyclopentyl-2-(2,4-dimethoxyphenyl)acetamide
CID 17474203
(2S)-N-cyclopentyl-2-(2-methoxyphenoxy)propanamide
CID 42082135
2-[4-(aminomethyl)-2-fluorophenoxy]-N-cyclopentylpropanamide
CID 107665579
2-[2-(hydroxymethyl)-5-methoxyphenoxy]-N-propan-2-ylpropanamide
CID 61267389
(2R)-N-cyclopropyl-2-(4-methoxyphenoxy)propanamide
CID 7865701
N-cyclopropyl-2-(2-formyl-4-methoxyphenoxy)propanamide
CID 43212710

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide?
The IUPAC name of 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide (CID 61268519) is 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide is COc1ccc(CN)c(OC(C)C(=O)NC2CCCC2)c1.
What is the InChIKey of 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide?
The InChIKey is NQYQIQTYWBEFSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11(16(19)18-13-5-3-4-6-13)21-15-9-14(20-2)8-7-12(15)10-17/h7-9,11,13H,3-6,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide?
2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide has a molecular weight of 292.38 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)-5-methoxyphenoxy]-N-cyclopentylpropanamide is sourced from PubChem (CID 61268519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).