N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine

C10H17N3O2 — CID 102633451

IUPACN-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine
SMILESCNC1CCCCC1OCc1ncon1
InChIInChI=1S/C10H17N3O2/c1-11-8-4-2-3-5-9(8)14-6-10-12-7-15-13-10/h7-9,11H,2-6H2,1H3
InChIKeyNINOTAIUBFVQOX-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.12
Rot. Bonds4

About N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine

N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine (PubChem CID 102633451) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine
PubChem CID102633451
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC NameN-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine
SMILESCNC1CCCCC1OCc1ncon1
InChIInChI=1S/C10H17N3O2/c1-11-8-4-2-3-5-9(8)14-6-10-12-7-15-13-10/h7-9,11H,2-6H2,1H3
InChIKeyNINOTAIUBFVQOX-UHFFFAOYSA-N
XLogP1.12
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl N-[(3R)-6-(1,2,4-oxadiazol-3-yl)oxan-3-yl]carbamate
CID 68311079
(3R,6S)-6-(1,2,4-oxadiazol-3-yl)oxan-3-amine;hydrochloride
CID 70871863
(3R,6S)-6-(1,2,4-oxadiazol-3-yl)oxan-3-amine
CID 70871864
tert-butyl N-[(3R,6S)-6-(1,2,4-oxadiazol-3-yl)oxan-3-yl]carbamate
CID 70913907
[(3R,6S)-6-(1,2,4-oxadiazol-3-yl)oxan-3-yl]carbamic acid
CID 89916728
(2R)-2-amino-N-[(3R,6S)-6-(1,2,4-oxadiazol-3-yl)oxan-3-yl]propanamide
CID 134289550
3-(Piperidin-4-yloxymethyl)-1,2,4-oxadiazole
CID 43346277
3-(Piperidin-3-yloxymethyl)-1,2,4-oxadiazole
CID 62328184
3-(Pyrrolidin-2-ylmethoxymethyl)-1,2,4-oxadiazole
CID 62333235
3-(Piperidin-2-ylmethoxymethyl)-1,2,4-oxadiazole
CID 62341249
3-(2-Piperidin-2-ylethoxymethyl)-1,2,4-oxadiazole
CID 62341405
4-(1,2,4-Oxadiazol-3-ylmethoxy)cyclohexan-1-amine
CID 62807753

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine?
The IUPAC name of N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine (CID 102633451) is N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine.
What is the SMILES notation for N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine?
The canonical SMILES for N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine is CNC1CCCCC1OCc1ncon1.
What is the InChIKey of N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine?
The InChIKey is NINOTAIUBFVQOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-11-8-4-2-3-5-9(8)14-6-10-12-7-15-13-10/h7-9,11H,2-6H2,1H3.
What are the key properties of N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine?
N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine has a molecular weight of 211.26 g/mol, XLogP of 1.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1,2,4-oxadiazol-3-ylmethoxy)cyclohexan-1-amine is sourced from PubChem (CID 102633451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).