2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine

C15H21NO2 — CID 70068192

IUPAC2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine
SMILESCOc1ccc(C2CC2N)cc1OC1CCCC1
InChIInChI=1S/C15H21NO2/c1-17-14-7-6-10(12-9-13(12)16)8-15(14)18-11-4-2-3-5-11/h6-8,11-13H,2-5,9,16H2,1H3
InChIKeyOFQCRBILXSBCBK-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.83
Rot. Bonds4

About 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine

2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine (PubChem CID 70068192) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine.

Molecular Properties

Compound Name2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine
PubChem CID70068192
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine
SMILESCOc1ccc(C2CC2N)cc1OC1CCCC1
InChIInChI=1S/C15H21NO2/c1-17-14-7-6-10(12-9-13(12)16)8-15(14)18-11-4-2-3-5-11/h6-8,11-13H,2-5,9,16H2,1H3
InChIKeyOFQCRBILXSBCBK-UHFFFAOYSA-N
XLogP2.83
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropyl]propan-2-ol
CID 70070788
(3S,4S)-3-(3-cyclopentyloxy-4-methoxyphenyl)-4-methylpyrrolidine
CID 150912606
trans-(1R,2S)-2-(3-methoxy-4-methylphenyl)cyclopropan-1-amine
CID 54194061
3-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidine
CID 10467846
(3R,4S)-1-carbamoyl-4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidine-3-carboxylic acid
CID 54097599
cis-(1S,2S)-2-[3-(difluoromethoxy)-4-methoxyphenyl]cyclohexan-1-amine
CID 57011853
2-cyclopentyloxy-4-iodo-1-methoxybenzene
CID 11197924
2-cyclopentyloxy-1-methoxy-4-methylbenzene;ethane
CID 142884364
trans-(1R,2S)-2-(4-fluoro-3-methoxyphenyl)cyclopropan-1-amine
CID 138987328
methyl (3S)-1-carbamoyl-4-(3-cyclopentyloxy-4-methoxyphenyl)pyrrolidine-3-carboxylate
CID 58598219
(3-cyclopentyloxy-4-methoxyphenyl)methylhydrazine
CID 143235659
4-(3-cyclopentyloxy-4-methoxyphenyl)oxane-2,6-dione
CID 71601856

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine?
The IUPAC name of 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine (CID 70068192) is 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine.
What is the SMILES notation for 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine?
The canonical SMILES for 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine is COc1ccc(C2CC2N)cc1OC1CCCC1.
What is the InChIKey of 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine?
The InChIKey is OFQCRBILXSBCBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-17-14-7-6-10(12-9-13(12)16)8-15(14)18-11-4-2-3-5-11/h6-8,11-13H,2-5,9,16H2,1H3.
What are the key properties of 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine?
2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine has a molecular weight of 247.34 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopentyloxy-4-methoxyphenyl)cyclopropan-1-amine is sourced from PubChem (CID 70068192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).