5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine

C14H24N6O — CID 166619182

IUPAC5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCc1n[nH]c(C)c1CCCN(C)c1nnc(CN(C)C)o1
InChIInChI=1S/C14H24N6O/c1-10-12(11(2)16-15-10)7-6-8-20(5)14-18-17-13(21-14)9-19(3)4/h6-9H2,1-5H3,(H,15,16)
InChIKeyURDSDRLNNFWBPV-UHFFFAOYSA-N
MW292.39 g/mol
LogP1.54
Rot. Bonds7

About 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine

5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine (PubChem CID 166619182) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine
PubChem CID166619182
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine
SMILESCc1n[nH]c(C)c1CCCN(C)c1nnc(CN(C)C)o1
InChIInChI=1S/C14H24N6O/c1-10-12(11(2)16-15-10)7-6-8-20(5)14-18-17-13(21-14)9-19(3)4/h6-9H2,1-5H3,(H,15,16)
InChIKeyURDSDRLNNFWBPV-UHFFFAOYSA-N
XLogP1.54
TPSA74.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine (CID 166619182) is 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine is Cc1n[nH]c(C)c1CCCN(C)c1nnc(CN(C)C)o1.
What is the InChIKey of 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine?
The InChIKey is URDSDRLNNFWBPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-10-12(11(2)16-15-10)7-6-8-20(5)14-18-17-13(21-14)9-19(3)4/h6-9H2,1-5H3,(H,15,16).
What are the key properties of 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine?
5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine has a molecular weight of 292.39 g/mol, XLogP of 1.54, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(dimethylamino)methyl]-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-N-methyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 166619182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).