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

C16H27N5O — CID 72897177

IUPAC5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine
SMILESCN1CCN(CC2(CNc3nnc(C4CCC4)o3)CC2)CC1
InChIInChI=1S/C16H27N5O/c1-20-7-9-21(10-8-20)12-16(5-6-16)11-17-15-19-18-14(22-15)13-3-2-4-13/h13H,2-12H2,1H3,(H,17,19)
InChIKeyFZUYMBBZSFKWDC-UHFFFAOYSA-N
MW305.43 g/mol
LogP1.78
Rot. Bonds6

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

5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine (PubChem CID 72897177) has the molecular formula C16H27N5O and a molecular weight of 305.43 g/mol. Its IUPAC name is 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine
PubChem CID72897177
Molecular FormulaC16H27N5O
Molecular Weight305.43 g/mol
Exact Mass305.22
IUPAC Name5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine
SMILESCN1CCN(CC2(CNc3nnc(C4CCC4)o3)CC2)CC1
InChIInChI=1S/C16H27N5O/c1-20-7-9-21(10-8-20)12-16(5-6-16)11-17-15-19-18-14(22-15)13-3-2-4-13/h13H,2-12H2,1H3,(H,17,19)
InChIKeyFZUYMBBZSFKWDC-UHFFFAOYSA-N
XLogP1.78
TPSA57.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine with MolForge

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Related Compounds

1-(6-Azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]ethanone
CID 171631728
1-(6-Azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one
CID 171632128
1-(6-Azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one;cyclopropane
CID 171632459
(2S)-1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one
CID 171632468
(2R)-1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)amino]propan-1-one
CID 174249242
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-[3-(methylaminomethyl)piperidin-1-yl]acetamide
CID 61204576
1-{2-[(5-Cyclopropyl-1,3,4-oxadiazol-2-YL)amino]ethyl}piperidine-3-carboxamide
CID 72851434
2-[4-(5-Cyclobutyl-1,3,4-oxadiazol-2-YL)piperazin-1-YL]-N-isopropylacetamide
CID 72874875
4-[(5-Cyclobutyl-1,3,4-oxadiazol-2-YL)amino]-N-cyclohexylpiperidine-1-carboxamide
CID 72881725
1-(cyclopropylcarbonyl)-N-(5-ethyl-1,3,4-oxadiazol-2-yl)piperidin-3-amine
CID 72905500
N-(2-methyl-2-piperidin-1-ylpropyl)-5-propyl-1,3,4-oxadiazol-2-amine
CID 72909107
2-Cyclobutyl-5-piperazin-1-yl-1,3,4-oxadiazole
CID 84070164

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine (CID 72897177) is 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine is CN1CCN(CC2(CNc3nnc(C4CCC4)o3)CC2)CC1.
What is the InChIKey of 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine?
The InChIKey is FZUYMBBZSFKWDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O/c1-20-7-9-21(10-8-20)12-16(5-6-16)11-17-15-19-18-14(22-15)13-3-2-4-13/h13H,2-12H2,1H3,(H,17,19).
What are the key properties of 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine?
5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine has a molecular weight of 305.43 g/mol, XLogP of 1.78, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-N-[[1-[(4-methylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 72897177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).