trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol

C10H17N3O2 — CID 106416752

IUPACtrans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol
SMILESCc1noc(CCN[C@@H]2CCC[C@H]2O)n1
InChIInChI=1S/C10H17N3O2/c1-7-12-10(15-13-7)5-6-11-8-3-2-4-9(8)14/h8-9,11,14H,2-6H2,1H3/t8-,9-/m1/s1
InChIKeyFCNZDXYJLFSTHN-RKDXNWHRSA-N
MW211.26 g/mol
LogP0.42
Rot. Bonds4

About trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol

trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol (PubChem CID 106416752) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol
PubChem CID106416752
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Nametrans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol
SMILESCc1noc(CCN[C@@H]2CCC[C@H]2O)n1
InChIInChI=1S/C10H17N3O2/c1-7-12-10(15-13-7)5-6-11-8-3-2-4-9(8)14/h8-9,11,14H,2-6H2,1H3/t8-,9-/m1/s1
InChIKeyFCNZDXYJLFSTHN-RKDXNWHRSA-N
XLogP0.42
TPSA71.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]cyclohex-2-en-1-amine
CID 106417007
N-(cyclobutylmethyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)ethanamine
CID 106414085
trans-(1S,2S)-2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol
CID 106399719
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]bicyclo[3.2.0]hept-3-en-6-amine
CID 106414334
3,4-dimethyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]cyclohexan-1-amine
CID 104854152
2-[2-(1,2,4-oxadiazol-5-yl)ethylamino]cyclohexan-1-ol
CID 106400144
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 104844783
4,4-dimethyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]cycloheptan-1-amine
CID 106414159
2-fluoro-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]cyclopentan-1-amine
CID 126857808
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]thiohydroxylamine
CID 155439756
1-(cyclobutylmethyl)-2-methyl-3-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]guanidine
CID 119151403
2-chloro-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 106414187

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol?
The IUPAC name of trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol (CID 106416752) is trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol is Cc1noc(CCN[C@@H]2CCC[C@H]2O)n1.
What is the InChIKey of trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol?
The InChIKey is FCNZDXYJLFSTHN-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-7-12-10(15-13-7)5-6-11-8-3-2-4-9(8)14/h8-9,11,14H,2-6H2,1H3/t8-,9-/m1/s1.
What are the key properties of trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol?
trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol has a molecular weight of 211.26 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]cyclopentan-1-ol is sourced from PubChem (CID 106416752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).