N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide

C17H25NO3 — CID 142072683

IUPACN-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide
SMILESCOc1ccc(C(C)CNC(C)=O)cc1OC1CCCC1
InChIInChI=1S/C17H25NO3/c1-12(11-18-13(2)19)14-8-9-16(20-3)17(10-14)21-15-6-4-5-7-15/h8-10,12,15H,4-7,11H2,1-3H3,(H,18,19)
InChIKeyZOTABZWBRGPUQZ-UHFFFAOYSA-N
MW291.39 g/mol
LogP3.26
Rot. Bonds6

About N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide

N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide (PubChem CID 142072683) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide.

Molecular Properties

Compound NameN-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide
PubChem CID142072683
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC NameN-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide
SMILESCOc1ccc(C(C)CNC(C)=O)cc1OC1CCCC1
InChIInChI=1S/C17H25NO3/c1-12(11-18-13(2)19)14-8-9-16(20-3)17(10-14)21-15-6-4-5-7-15/h8-10,12,15H,4-7,11H2,1-3H3,(H,18,19)
InChIKeyZOTABZWBRGPUQZ-UHFFFAOYSA-N
XLogP3.26
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-cyclobutyloxy-4-methoxyphenyl)propanoic acid
CID 117378818
N-[2-(3,4-dimethoxyphenyl)-3-methylbutyl]acetamide
CID 110314862
N-[2-(3-cyclopentyloxy-4-methoxyphenyl)-4-phenylbut-3-ynyl]-3-oxobutanamide
CID 54216808
1-(4-cyclopentyloxy-3-methoxyphenyl)ethanol
CID 43503851
1-(3-cyclopentyloxy-4-methoxyphenyl)-3-methylbutan-1-one
CID 19892499
methyl (3S)-3-(3-cyclopentyloxy-4-methoxyphenyl)-4-nitrobutanoate
CID 24741046
N-(cyclopentylmethyl)-2-(3,4-dimethoxyphenyl)-3-methylbutanamide
CID 110307535
(E)-N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]-3-(3,4-dimethoxyphenyl)prop-2-enamide
CID 55745702
2-[butan-2-yl-(3-cyclopentyloxy-4-methoxybenzoyl)amino]acetic acid
CID 120529887
2-amino-2-(4-cyclopentyloxy-3-methoxyphenyl)acetic acid
CID 77129521
(2S)-2-amino-2-(4-cyclopentyloxy-3-methoxyphenyl)acetic acid
CID 66513349
(1R)-1-(4-cyclopentyloxy-3-methoxyphenyl)ethanamine
CID 30119294

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide?
The IUPAC name of N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide (CID 142072683) is N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide.
What is the SMILES notation for N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide?
The canonical SMILES for N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide is COc1ccc(C(C)CNC(C)=O)cc1OC1CCCC1.
What is the InChIKey of N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide?
The InChIKey is ZOTABZWBRGPUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-12(11-18-13(2)19)14-8-9-16(20-3)17(10-14)21-15-6-4-5-7-15/h8-10,12,15H,4-7,11H2,1-3H3,(H,18,19).
What are the key properties of N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide?
N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide has a molecular weight of 291.39 g/mol, XLogP of 3.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-cyclopentyloxy-4-methoxyphenyl)propyl]acetamide is sourced from PubChem (CID 142072683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).