N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine

C11H17N3O — CID 166241934

IUPACN-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine
SMILESC1CC(CNc2nnc(CC3CC3)o2)C1
InChIInChI=1S/C11H17N3O/c1-2-9(3-1)7-12-11-14-13-10(15-11)6-8-4-5-8/h8-9H,1-7H2,(H,12,14)
InChIKeyZJKMHNYVTDYCPC-UHFFFAOYSA-N
MW207.28 g/mol
LogP2.23
Rot. Bonds5

About N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine

N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine (PubChem CID 166241934) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine
PubChem CID166241934
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine
SMILESC1CC(CNc2nnc(CC3CC3)o2)C1
InChIInChI=1S/C11H17N3O/c1-2-9(3-1)7-12-11-14-13-10(15-11)6-8-4-5-8/h8-9H,1-7H2,(H,12,14)
InChIKeyZJKMHNYVTDYCPC-UHFFFAOYSA-N
XLogP2.23
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(aminomethyl)-N-(thian-4-ylmethyl)-1,3,4-oxadiazol-2-amine
CID 106964738
5-[(tert-butylamino)methyl]-N-(cyclohexylmethyl)-1,3,4-oxadiazol-2-amine
CID 106968921
2-(chloromethyl)-5-(cyclobutylmethyl)-1,3,4-oxadiazole
CID 103162193
5-(2-aminoethyl)-N-[(4-ethylcyclohexyl)methyl]-1,3,4-oxadiazol-2-amine
CID 106959682
5-(ethylaminomethyl)-N-[(3-methylcyclohexyl)methyl]-1,3,4-oxadiazol-2-amine
CID 114131448
N-[(4-methylcyclohexyl)methyl]-5-(propylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106960948
5-[(tert-butylamino)methyl]-N-(thian-4-ylmethyl)-1,3,4-oxadiazol-2-amine
CID 106964745
N-[[5-(cyclobutylmethyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 103166366
2-[5-(cyclobutylmethyl)-1,3,4-oxadiazol-2-yl]-N-methylethanamine
CID 103166389
2-(cyclopentylmethyl)-5-methyl-1,3,4-oxadiazole
CID 53017482
N-[3-[5-(cyclobutylmethyl)-1,3,4-oxadiazol-2-yl]propyl]-2-methylpropan-2-amine
CID 103166380
5-(cyclohexylmethyl)-1,3,4-oxadiazol-2-amine
CID 28780022

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine (CID 166241934) is N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine is C1CC(CNc2nnc(CC3CC3)o2)C1.
What is the InChIKey of N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine?
The InChIKey is ZJKMHNYVTDYCPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-2-9(3-1)7-12-11-14-13-10(15-11)6-8-4-5-8/h8-9H,1-7H2,(H,12,14).
What are the key properties of N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine?
N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine has a molecular weight of 207.28 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-5-(cyclopropylmethyl)-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 166241934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).