N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine

C15H19N3O — CID 62881941

IUPACN-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nnc(C2(c3ccccc3)CC2)o1
InChIInChI=1S/C15H19N3O/c1-11(2)16-10-13-17-18-14(19-13)15(8-9-15)12-6-4-3-5-7-12/h3-7,11,16H,8-10H2,1-2H3
InChIKeyWPWGVIDKOOBHGN-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.65
Rot. Bonds5

About N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine

N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine (PubChem CID 62881941) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
PubChem CID62881941
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nnc(C2(c3ccccc3)CC2)o1
InChIInChI=1S/C15H19N3O/c1-11(2)16-10-13-17-18-14(19-13)15(8-9-15)12-6-4-3-5-7-12/h3-7,11,16H,8-10H2,1-2H3
InChIKeyWPWGVIDKOOBHGN-UHFFFAOYSA-N
XLogP2.65
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine with MolForge

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Related Compounds

3-[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpropan-1-amine
CID 62879543
N-[[5-(2-methylthiolan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 81450585
5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-amine
CID 62877248
2-(4-phenyloxan-4-yl)-5-propan-2-yl-1,3,4-oxadiazole
CID 56784751
N-benzyl-N-methyl-5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106966869
N-[(2-bromophenyl)methyl]-5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106971211
N-[[5-[(2-methoxyphenyl)methyl]-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 62139060
5-(1-phenylcyclopentyl)-1,3,4-oxadiazole-2-carboxylic acid
CID 166104460
N-[[5-(4-iodophenyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 62138872
N-(2-bromophenyl)-5-[(propan-2-ylamino)methyl]-1,3,4-oxadiazol-2-amine
CID 106968057
5-(1-methyl-4-phenylpiperidin-4-yl)-1,3,4-oxadiazol-2-amine
CID 21300164
N-[[5-(2,3-dihydro-1,4-benzodioxin-3-yl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine
CID 62137759

Frequently Asked Questions

What is the IUPAC name of N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine (CID 62881941) is N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine is CC(C)NCc1nnc(C2(c3ccccc3)CC2)o1.
What is the InChIKey of N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
The InChIKey is WPWGVIDKOOBHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11(2)16-10-13-17-18-14(19-13)15(8-9-15)12-6-4-3-5-7-12/h3-7,11,16H,8-10H2,1-2H3.
What are the key properties of N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine?
N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine has a molecular weight of 257.34 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(1-phenylcyclopropyl)-1,3,4-oxadiazol-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 62881941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).