6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine

C13H17N5O — CID 72857867

IUPAC6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine
SMILESCCc1nnc(CN(C)c2cc(C3CC3)ncn2)o1
InChIInChI=1S/C13H17N5O/c1-3-12-16-17-13(19-12)7-18(2)11-6-10(9-4-5-9)14-8-15-11/h6,8-9H,3-5,7H2,1-2H3
InChIKeyQEIDWGTUDYPDJI-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.94
Rot. Bonds5

About 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine

6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine (PubChem CID 72857867) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine
PubChem CID72857867
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine
SMILESCCc1nnc(CN(C)c2cc(C3CC3)ncn2)o1
InChIInChI=1S/C13H17N5O/c1-3-12-16-17-13(19-12)7-18(2)11-6-10(9-4-5-9)14-8-15-11/h6,8-9H,3-5,7H2,1-2H3
InChIKeyQEIDWGTUDYPDJI-UHFFFAOYSA-N
XLogP1.94
TPSA67.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine with MolForge

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Related Compounds

N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-4-(3,3,3-trifluoropropyl)pyrimidin-2-amine
CID 56869781
N-cyclopropyl-6-methyl-N-(1-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperidin-4-yl)pyrimidin-4-amine
CID 126890543
4-(Propan-2-yl)-6-(5-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}-octahydropyrrolo[3,4-c]pyrrol-2-yl)pyrimidine
CID 126932090
4-Tert-butyl-6-(5-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}-octahydropyrrolo[3,4-c]pyrrol-2-yl)pyrimidine
CID 126932431
4-Cyclopropyl-6-(5-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}-octahydropyrrolo[3,4-c]pyrrol-2-yl)pyrimidine
CID 126932729
4-Cyclobutyl-6-(5-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}-octahydropyrrolo[3,4-c]pyrrol-2-yl)pyrimidine
CID 126933731
N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-6-ethyl-5-fluoropyrimidin-4-amine
CID 133497967
4-Cyclopropyl-6-(4-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperazin-1-yl)pyrimidine
CID 145869085
2-Cyclopropyl-4-ethyl-6-(4-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperazin-1-yl)pyrimidine
CID 154828962
4-Cyclopropyl-2-(methylsulfanyl)-6-(4-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperazin-1-yl)pyrimidine
CID 155798621
4-Cyclobutyl-2-cyclopropyl-6-(4-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperazin-1-yl)pyrimidine
CID 155942025
4-Tert-butyl-6-(4-{[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]methyl}piperazin-1-yl)pyrimidine
CID 156008117

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine?
The IUPAC name of 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine (CID 72857867) is 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine is CCc1nnc(CN(C)c2cc(C3CC3)ncn2)o1.
What is the InChIKey of 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine?
The InChIKey is QEIDWGTUDYPDJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-3-12-16-17-13(19-12)7-18(2)11-6-10(9-4-5-9)14-8-15-11/h6,8-9H,3-5,7H2,1-2H3.
What are the key properties of 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine?
6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine has a molecular weight of 259.31 g/mol, XLogP of 1.94, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methylpyrimidin-4-amine is sourced from PubChem (CID 72857867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).