[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol

C15H23NO3 — CID 79134964

IUPAC[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol
SMILESCOc1ccc(OC)c(C(O)C2(CN)CCCC2)c1
InChIInChI=1S/C15H23NO3/c1-18-11-5-6-13(19-2)12(9-11)14(17)15(10-16)7-3-4-8-15/h5-6,9,14,17H,3-4,7-8,10,16H2,1-2H3
InChIKeyDNYCMUVKAUUEDK-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.26
Rot. Bonds5

About [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol

[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol (PubChem CID 79134964) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol.

Molecular Properties

Compound Name[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol
PubChem CID79134964
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol
SMILESCOc1ccc(OC)c(C(O)C2(CN)CCCC2)c1
InChIInChI=1S/C15H23NO3/c1-18-11-5-6-13(19-2)12(9-11)14(17)15(10-16)7-3-4-8-15/h5-6,9,14,17H,3-4,7-8,10,16H2,1-2H3
InChIKeyDNYCMUVKAUUEDK-UHFFFAOYSA-N
XLogP2.26
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(aminomethyl)cyclopentyl]-(2,4-dimethoxyphenyl)methanol
CID 79135621
1-[(2,5-dimethoxyphenyl)-hydroxymethyl]cyclopentan-1-ol
CID 103448378
[1-(aminomethyl)cyclobutyl]-(5-bromo-2-methoxyphenyl)methanol
CID 79135689
(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol
CID 79067398
(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
CID 106828269
[1-(aminomethyl)cyclobutyl]-(2,3,4-trimethoxyphenyl)methanol
CID 79138330
[3-(aminomethyl)oxetan-3-yl]-(2,5-dimethoxyphenyl)methanamine
CID 116944913
[1-(aminomethyl)cyclohexyl]-[2-(methoxymethyl)phenyl]methanol
CID 79123286
[1-(aminomethyl)-3-ethylcyclohexyl]-(5-bromo-2-methoxyphenyl)methanol
CID 79126020
amino-(2,5-dimethoxyphenyl)methanol
CID 116939586
[1-(aminomethyl)cyclopropyl]-(2,4-dimethoxyphenyl)methanamine
CID 116943372
2-[[1-(aminomethyl)cyclobutyl]-hydroxymethyl]phenol
CID 105460570

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol?
The IUPAC name of [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol (CID 79134964) is [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol.
What is the SMILES notation for [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol?
The canonical SMILES for [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol is COc1ccc(OC)c(C(O)C2(CN)CCCC2)c1.
What is the InChIKey of [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol?
The InChIKey is DNYCMUVKAUUEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-18-11-5-6-13(19-2)12(9-11)14(17)15(10-16)7-3-4-8-15/h5-6,9,14,17H,3-4,7-8,10,16H2,1-2H3.
What are the key properties of [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol?
[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol has a molecular weight of 265.35 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol is sourced from PubChem (CID 79134964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).