1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol

C11H21NO2 — CID 79123467

IUPAC1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol
SMILESCC1CCCC1(O)C1(CN)CCOC1
InChIInChI=1S/C11H21NO2/c1-9-3-2-4-11(9,13)10(7-12)5-6-14-8-10/h9,13H,2-8,12H2,1H3
InChIKeyCCARDWTUHRWIJN-UHFFFAOYSA-N
MW199.29 g/mol
LogP0.90
Rot. Bonds2

About 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol

1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol (PubChem CID 79123467) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol.

Molecular Properties

Compound Name1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol
PubChem CID79123467
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol
SMILESCC1CCCC1(O)C1(CN)CCOC1
InChIInChI=1S/C11H21NO2/c1-9-3-2-4-11(9,13)10(7-12)5-6-14-8-10/h9,13H,2-8,12H2,1H3
InChIKeyCCARDWTUHRWIJN-UHFFFAOYSA-N
XLogP0.90
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(Aminomethyl)-2-(oxolan-2-ylmethyl)cyclopentan-1-ol
CID 65394024
1-[3-(Aminomethyl)oxolan-3-yl]-4-propylcycloheptan-1-ol
CID 79123282
1-[3-(Aminomethyl)oxolan-3-yl]-2-ethylcyclohexan-1-ol
CID 79123437
1-[3-(Aminomethyl)oxolan-3-yl]-3,5-dimethylcyclohexan-1-ol
CID 79123946
1-[4-(Aminomethyl)oxan-4-yl]-2-methylcyclopentan-1-ol
CID 79123959
1-[3-(Aminomethyl)oxolan-3-yl]-3-ethylcyclohexan-1-ol
CID 79124178
1-[2-(Aminomethyl)-7-oxabicyclo[2.2.1]heptan-2-yl]-2-methylcyclopentan-1-ol
CID 79124214
1-[3-(Aminomethyl)oxolan-3-yl]-4,4-dimethylcycloheptan-1-ol
CID 79124223
1-[3-(Aminomethyl)oxolan-3-yl]-4-ethylcycloheptan-1-ol
CID 79124438
4-[1-(Aminomethyl)-3-methylcyclopentyl]oxepan-4-ol
CID 79124630
1-[3-(Aminomethyl)oxolan-3-yl]-4-methylcycloheptan-1-ol
CID 79124841
4-[1-(Aminomethyl)-3-ethylcyclopentyl]oxepan-4-ol
CID 79125244

Frequently Asked Questions

What is the IUPAC name of 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol?
The IUPAC name of 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol (CID 79123467) is 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol.
What is the SMILES notation for 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol?
The canonical SMILES for 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol is CC1CCCC1(O)C1(CN)CCOC1.
What is the InChIKey of 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol?
The InChIKey is CCARDWTUHRWIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9-3-2-4-11(9,13)10(7-12)5-6-14-8-10/h9,13H,2-8,12H2,1H3.
What are the key properties of 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol?
1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol has a molecular weight of 199.29 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(aminomethyl)oxolan-3-yl]-2-methylcyclopentan-1-ol is sourced from PubChem (CID 79123467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).