[1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol

C11H21NO2S — CID 106497567

IUPAC[1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol
SMILESNC1(CO)CCC(SCC2CCCO2)C1
InChIInChI=1S/C11H21NO2S/c12-11(8-13)4-3-10(6-11)15-7-9-2-1-5-14-9/h9-10,13H,1-8,12H2
InChIKeyWFRYRVVOOICVRS-UHFFFAOYSA-N
MW231.36 g/mol
LogP1.14
Rot. Bonds4

About [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol

[1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol (PubChem CID 106497567) has the molecular formula C11H21NO2S and a molecular weight of 231.36 g/mol. Its IUPAC name is [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol
PubChem CID106497567
Molecular FormulaC11H21NO2S
Molecular Weight231.36 g/mol
Exact Mass231.13
IUPAC Name[1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol
SMILESNC1(CO)CCC(SCC2CCCO2)C1
InChIInChI=1S/C11H21NO2S/c12-11(8-13)4-3-10(6-11)15-7-9-2-1-5-14-9/h9-10,13H,1-8,12H2
InChIKeyWFRYRVVOOICVRS-UHFFFAOYSA-N
XLogP1.14
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.36
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(oxolan-2-ylmethylsulfanyl)-1-(propan-2-ylamino)cyclopentane-1-carboxylic acid
CID 106495654
1-(methylamino)-3-(oxolan-2-ylmethylsulfanyl)cyclohexane-1-carboxamide
CID 106495653
[1-amino-3-[ethyl(oxolan-2-ylmethyl)amino]cyclopentyl]methanol
CID 79656703
methyl 1-(cyclopropylamino)-3-(oxolan-2-ylmethylsulfanyl)cyclopentane-1-carboxylate
CID 106495655
1-(ethylamino)-3-(oxolan-2-ylmethylsulfanyl)cyclohexane-1-carbonitrile
CID 106495474
4-amino-4-(oxolan-2-ylmethyl)cyclohexan-1-ol
CID 126979079
(2S)-2-[[(2R)-oxolan-2-yl]methylsulfanylmethyl]oxolane
CID 129402242
3-(oxolan-2-ylmethylsulfanyl)cyclopentan-1-one
CID 106495095
(1-amino-3-methylcyclopentyl)methanol
CID 64516223
1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
CID 3607647
[1-(oxolan-2-ylmethyl)cyclohexyl]methanol
CID 66024131
1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopropan-1-amine
CID 65458658

Frequently Asked Questions

What is the IUPAC name of [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol?
The IUPAC name of [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol (CID 106497567) is [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol.
What is the SMILES notation for [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol?
The canonical SMILES for [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol is NC1(CO)CCC(SCC2CCCO2)C1.
What is the InChIKey of [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol?
The InChIKey is WFRYRVVOOICVRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2S/c12-11(8-13)4-3-10(6-11)15-7-9-2-1-5-14-9/h9-10,13H,1-8,12H2.
What are the key properties of [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol?
[1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol has a molecular weight of 231.36 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-amino-3-(oxolan-2-ylmethylsulfanyl)cyclopentyl]methanol is sourced from PubChem (CID 106497567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).