5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine

C14H24N4O — CID 106967918

IUPAC5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine
SMILESCC1CCCC(Nc2nnc(CNC3CC3)o2)C1C
InChIInChI=1S/C14H24N4O/c1-9-4-3-5-12(10(9)2)16-14-18-17-13(19-14)8-15-11-6-7-11/h9-12,15H,3-8H2,1-2H3,(H,16,18)
InChIKeyYBLAQNOVBDUBNK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.56
Rot. Bonds5

About 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine

5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine (PubChem CID 106967918) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine
PubChem CID106967918
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine
SMILESCC1CCCC(Nc2nnc(CNC3CC3)o2)C1C
InChIInChI=1S/C14H24N4O/c1-9-4-3-5-12(10(9)2)16-14-18-17-13(19-14)8-15-11-6-7-11/h9-12,15H,3-8H2,1-2H3,(H,16,18)
InChIKeyYBLAQNOVBDUBNK-UHFFFAOYSA-N
XLogP2.56
TPSA62.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dimethylcyclopentyl)-5-(methylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106962353
5-(methylaminomethyl)-N-(2-methylcyclopentyl)-1,3,4-oxadiazol-2-amine
CID 106961401
5-[(cyclopropylamino)methyl]-N-(3,4-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine
CID 106962068
N-cycloheptyl-5-[(cyclopropylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106968561
5-[(cyclopropylamino)methyl]-N-(3,5-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine
CID 106962278
5-(1-aminoethyl)-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine
CID 106967919
5-[(cyclopropylamino)methyl]-N-(1,1-dioxothian-3-yl)-1,3,4-oxadiazol-2-amine
CID 106961478
5-[(cyclopropylamino)methyl]-N-[1-(oxolan-2-yl)ethyl]-1,3,4-oxadiazol-2-amine
CID 106969066
5-[(cyclopropylamino)methyl]-N-(3,3-dimethylbutan-2-yl)-1,3,4-oxadiazol-2-amine
CID 106964848
5-[(cyclopropylamino)methyl]-N-(3-methylsulfanylbutyl)-1,3,4-oxadiazol-2-amine
CID 106965113
N-(2-methoxycyclopentyl)-5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106960449
N-[[5-(2-methylcyclopentyl)-1,3-oxazol-2-yl]methyl]cyclopropanamine
CID 107185095

Frequently Asked Questions

What is the IUPAC name of 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine (CID 106967918) is 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine is CC1CCCC(Nc2nnc(CNC3CC3)o2)C1C.
What is the InChIKey of 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine?
The InChIKey is YBLAQNOVBDUBNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-9-4-3-5-12(10(9)2)16-14-18-17-13(19-14)8-15-11-6-7-11/h9-12,15H,3-8H2,1-2H3,(H,16,18).
What are the key properties of 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine?
5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine has a molecular weight of 264.37 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopropylamino)methyl]-N-(2,3-dimethylcyclohexyl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 106967918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).