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

C16H25NO3 — CID 79067398

IUPAC(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol
SMILESCOc1ccc(OC)c(C(O)C2(N(C)C)CCCC2)c1
InChIInChI=1S/C16H25NO3/c1-17(2)16(9-5-6-10-16)15(18)13-11-12(19-3)7-8-14(13)20-4/h7-8,11,15,18H,5-6,9-10H2,1-4H3
InChIKeyZVSUYDASLAIYKC-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.61
Rot. Bonds5

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

(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol (PubChem CID 79067398) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol
PubChem CID79067398
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC Name(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol
SMILESCOc1ccc(OC)c(C(O)C2(N(C)C)CCCC2)c1
InChIInChI=1S/C16H25NO3/c1-17(2)16(9-5-6-10-16)15(18)13-11-12(19-3)7-8-14(13)20-4/h7-8,11,15,18H,5-6,9-10H2,1-4H3
InChIKeyZVSUYDASLAIYKC-UHFFFAOYSA-N
XLogP2.61
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2,4-dimethoxyphenyl)-[1-(dimethylamino)cyclohexyl]methanol
CID 79061364
[1-(dimethylamino)cycloheptyl]-(2-methoxy-5-methylphenyl)methanol
CID 79063099
1-[(2,5-dimethoxyphenyl)-hydroxymethyl]cyclopentan-1-ol
CID 103448378
[1-(dimethylamino)cyclohexyl]-(5-fluoro-2-methoxyphenyl)methanol
CID 82769611
(2,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
CID 106828269
[1-(aminomethyl)cyclopentyl]-(2,5-dimethoxyphenyl)methanol
CID 79134964
[1-(dimethylamino)cyclohexyl]-(4-methoxyphenyl)methanol
CID 79067098
[1-(dimethylamino)cyclohexyl]-(3-fluoro-4-methoxyphenyl)methanol
CID 79066938
[1-(dimethylamino)cyclopentyl]-(2-ethoxyphenyl)methanol
CID 79067542
1-[amino-(4-methoxy-2-methylphenyl)methyl]-N,N-dimethylcyclopentan-1-amine
CID 79070446
[1-(dimethylamino)-4-methylcyclohexyl]-(5-fluoro-2-methoxyphenyl)methanol
CID 82771557
amino-(2,5-dimethoxyphenyl)methanol
CID 116939586

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol?
The IUPAC name of (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol (CID 79067398) is (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol.
What is the SMILES notation for (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol?
The canonical SMILES for (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol is COc1ccc(OC)c(C(O)C2(N(C)C)CCCC2)c1.
What is the InChIKey of (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol?
The InChIKey is ZVSUYDASLAIYKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-17(2)16(9-5-6-10-16)15(18)13-11-12(19-3)7-8-14(13)20-4/h7-8,11,15,18H,5-6,9-10H2,1-4H3.
What are the key properties of (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol?
(2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol has a molecular weight of 279.38 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyphenyl)-[1-(dimethylamino)cyclopentyl]methanol is sourced from PubChem (CID 79067398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).