3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol

C15H23NO2 — CID 103270675

IUPAC3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
SMILESCOCc1cccc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C15H23NO2/c1-18-11-14-4-2-3-12(7-14)9-16-10-13-5-6-15(17)8-13/h2-4,7,13,15-17H,5-6,8-11H2,1H3
InChIKeyMPUIODXDYSJICQ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.08
Rot. Bonds6

About 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol

3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol (PubChem CID 103270675) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
PubChem CID103270675
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
SMILESCOCc1cccc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C15H23NO2/c1-18-11-14-4-2-3-12(7-14)9-16-10-13-5-6-15(17)8-13/h2-4,7,13,15-17H,5-6,8-11H2,1H3
InChIKeyMPUIODXDYSJICQ-UHFFFAOYSA-N
XLogP2.08
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270659
3-[[[2-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
CID 114146215
3-[[[4-(methoxymethyl)phenyl]methylamino]methyl]cyclohexan-1-ol
CID 103699801
3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzamide
CID 103270759
3-[[(6-methoxynaphthalen-2-yl)methylamino]methyl]cyclopentan-1-ol
CID 103270839
1-cyclopropyl-N-[[3-[(2-methylpropan-2-yl)oxymethyl]phenyl]methyl]methanamine
CID 119110641
N'-hydroxy-3-[[(3-hydroxycyclopentyl)methylamino]methyl]benzenecarboximidamide
CID 106136286
3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270774
N-[[3-(methoxymethyl)phenyl]methyl]-1-(thian-2-yl)methanamine
CID 80600459
4-[[(3-hydroxycyclopentyl)methylamino]methyl]-2-methoxybenzonitrile
CID 106129848
2-[[3-(methoxymethyl)phenyl]methylamino]ethanol
CID 61004164
1-(1,1-dioxothiolan-2-yl)-N-[[3-(methoxymethyl)phenyl]methyl]methanamine
CID 81039723

Frequently Asked Questions

What is the IUPAC name of 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol (CID 103270675) is 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol is COCc1cccc(CNCC2CCC(O)C2)c1.
What is the InChIKey of 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol?
The InChIKey is MPUIODXDYSJICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-18-11-14-4-2-3-12(7-14)9-16-10-13-5-6-15(17)8-13/h2-4,7,13,15-17H,5-6,8-11H2,1H3.
What are the key properties of 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol?
3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol has a molecular weight of 249.35 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 103270675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).