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

C10H16N4O — CID 106968644

IUPACN-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCN(c1nnc(CNC2CC2)o1)C1CC1
InChIInChI=1S/C10H16N4O/c1-14(8-4-5-8)10-13-12-9(15-10)6-11-7-2-3-7/h7-8,11H,2-6H2,1H3
InChIKeyYGNBNVITAKSSKO-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.92
Rot. Bonds5

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

N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine (PubChem CID 106968644) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine
PubChem CID106968644
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCN(c1nnc(CNC2CC2)o1)C1CC1
InChIInChI=1S/C10H16N4O/c1-14(8-4-5-8)10-13-12-9(15-10)6-11-7-2-3-7/h7-8,11H,2-6H2,1H3
InChIKeyYGNBNVITAKSSKO-UHFFFAOYSA-N
XLogP0.92
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(cyclopropylamino)methyl]-N,N-dimethyl-1,3,4-oxadiazol-2-amine
CID 82468411
5-[(cyclopropylamino)methyl]-N-methyl-N-propyl-1,3,4-oxadiazol-2-amine
CID 106968742
5-[(cyclopropylamino)methyl]-N-methyl-N-(4-methylpentan-2-yl)-1,3,4-oxadiazol-2-amine
CID 106959586
N-cyclohexyl-5-[(cyclopropylamino)methyl]-N-ethyl-1,3,4-oxadiazol-2-amine
CID 106968014
5-[(cyclopropylamino)methyl]-N-(4-ethylphenyl)-N-methyl-1,3,4-oxadiazol-2-amine
CID 106971055
5-[(cyclopropylamino)methyl]-N,N-bis(2-methoxyethyl)-1,3,4-oxadiazol-2-amine
CID 106959575
N-[1-(4-chlorophenyl)ethyl]-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine
CID 106961055
N-butan-2-yl-N-butyl-5-[(cyclopropylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106960156
N-methyl-N-(oxan-4-yl)-5-(propylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106969389
N-methyl-N-(3-methylcyclohexyl)-5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106970227
2-[[5-[(cyclopropylamino)methyl]-1,3,4-oxadiazol-2-yl]amino]propanamide
CID 106964115
N-[[5-(2-bicyclo[2.2.1]heptanyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopropanamine
CID 55039643

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine (CID 106968644) is N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine is CN(c1nnc(CNC2CC2)o1)C1CC1.
What is the InChIKey of N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine?
The InChIKey is YGNBNVITAKSSKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-14(8-4-5-8)10-13-12-9(15-10)6-11-7-2-3-7/h7-8,11H,2-6H2,1H3.
What are the key properties of N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine?
N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine has a molecular weight of 208.26 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 106968644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).