2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol

C14H26N4O2 — CID 106965820

IUPAC2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol
SMILESCCCNC(C)c1nnc(N(C)C2CCCCC2O)o1
InChIInChI=1S/C14H26N4O2/c1-4-9-15-10(2)13-16-17-14(20-13)18(3)11-7-5-6-8-12(11)19/h10-12,15,19H,4-9H2,1-3H3
InChIKeyHFWOFXWSGGJHPM-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.87
Rot. Bonds6

About 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol

2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol (PubChem CID 106965820) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol
PubChem CID106965820
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol
SMILESCCCNC(C)c1nnc(N(C)C2CCCCC2O)o1
InChIInChI=1S/C14H26N4O2/c1-4-9-15-10(2)13-16-17-14(20-13)18(3)11-7-5-6-8-12(11)19/h10-12,15,19H,4-9H2,1-3H3
InChIKeyHFWOFXWSGGJHPM-UHFFFAOYSA-N
XLogP1.87
TPSA74.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-cycloheptyl-N-methyl-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106969352
N-(4-ethylcyclohexyl)-N-methyl-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106959782
N-methyl-N-pentan-2-yl-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106969331
1-[[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]methyl]cyclopentan-1-ol
CID 106965603
N-cyclopropyl-2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]acetamide
CID 106971142
N-methyl-N-(1-methylsulfanylbutan-2-yl)-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106964208
2-[ethyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]-N,N-dimethylacetamide
CID 106971179
N-(cyclohexylmethyl)-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106968919
2-[[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107495569
N-[1-[5-(cyclobutylmethyl)-1,3,4-oxadiazol-2-yl]ethyl]propan-1-amine
CID 103166387
N-(1-cyclohexylethyl)-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106960756
N-methyl-N-(2-phenylethyl)-5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-amine
CID 106961805

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol?
The IUPAC name of 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol (CID 106965820) is 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol?
The canonical SMILES for 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol is CCCNC(C)c1nnc(N(C)C2CCCCC2O)o1.
What is the InChIKey of 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol?
The InChIKey is HFWOFXWSGGJHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-4-9-15-10(2)13-16-17-14(20-13)18(3)11-7-5-6-8-12(11)19/h10-12,15,19H,4-9H2,1-3H3.
What are the key properties of 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol?
2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol has a molecular weight of 282.39 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]amino]cyclohexan-1-ol is sourced from PubChem (CID 106965820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).