1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol

C12H20N2O2 — CID 104579726

IUPAC1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol
SMILESCc1cnc(C(C)NCC2(O)CCCC2)o1
InChIInChI=1S/C12H20N2O2/c1-9-7-13-11(16-9)10(2)14-8-12(15)5-3-4-6-12/h7,10,14-15H,3-6,8H2,1-2H3
InChIKeyARLQSGLDEIHIBJ-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.94
Rot. Bonds4

About 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol

1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol (PubChem CID 104579726) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol
PubChem CID104579726
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol
SMILESCc1cnc(C(C)NCC2(O)CCCC2)o1
InChIInChI=1S/C12H20N2O2/c1-9-7-13-11(16-9)10(2)14-8-12(15)5-3-4-6-12/h7,10,14-15H,3-6,8H2,1-2H3
InChIKeyARLQSGLDEIHIBJ-UHFFFAOYSA-N
XLogP1.94
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-[1-[(1-hydroxycyclohexyl)methyl]pyrrolidin-3-yl]acetamide
CID 71927170
(3S)-3-methyl-4-[(5-methyl-1,3-oxazol-2-yl)methyl]-3-propylpiperazin-2-one
CID 99823808
N-(3-bicyclo[3.1.0]hexanyl)-5-methyl-1,3-oxazole-2-carboxamide
CID 128882272
tert-butyl N-[(1S,2S)-1-[5-(bromomethyl)-1,3-oxazol-2-yl]-2-methylbutyl]carbamate
CID 53466017
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 102672927
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-4-(trifluoromethyl)cyclohexan-1-amine
CID 104862556
6,6,6-trifluoro-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]hexan-2-amine
CID 104928143
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-(trifluoromethyl)cyclohexan-1-amine
CID 104934185
6,6,6-trifluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]hexan-2-amine
CID 113797310
N-[(3,3-difluorocyclopentyl)methyl]-1-(5-methyl-1,3-oxazol-2-yl)ethanamine
CID 114145626
cis-(1R,2S)-2-fluoro-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]cyclohexan-1-amine
CID 167916150
5-Methyl-2-pyrrolidin-2-yl-1,3-oxazole
CID 22256533

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol (CID 104579726) is 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol is Cc1cnc(C(C)NCC2(O)CCCC2)o1.
What is the InChIKey of 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol?
The InChIKey is ARLQSGLDEIHIBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-9-7-13-11(16-9)10(2)14-8-12(15)5-3-4-6-12/h7,10,14-15H,3-6,8H2,1-2H3.
What are the key properties of 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol?
1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol has a molecular weight of 224.30 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(5-methyl-1,3-oxazol-2-yl)ethylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 104579726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).