2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine

C14H17N5O — CID 103121808

IUPAC2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine
SMILESCC(C)(C)C(N)c1noc(-c2cnn3ccccc23)n1
InChIInChI=1S/C14H17N5O/c1-14(2,3)11(15)12-17-13(20-18-12)9-8-16-19-7-5-4-6-10(9)19/h4-8,11H,15H2,1-3H3
InChIKeyNFNPHJJJOOGZLN-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.43
Rot. Bonds2

About 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine

2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine (PubChem CID 103121808) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine
PubChem CID103121808
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine
SMILESCC(C)(C)C(N)c1noc(-c2cnn3ccccc23)n1
InChIInChI=1S/C14H17N5O/c1-14(2,3)11(15)12-17-13(20-18-12)9-8-16-19-7-5-4-6-10(9)19/h4-8,11H,15H2,1-3H3
InChIKeyNFNPHJJJOOGZLN-UHFFFAOYSA-N
XLogP2.43
TPSA82.24 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine (CID 103121808) is 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine is CC(C)(C)C(N)c1noc(-c2cnn3ccccc23)n1.
What is the InChIKey of 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine?
The InChIKey is NFNPHJJJOOGZLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-14(2,3)11(15)12-17-13(20-18-12)9-8-16-19-7-5-4-6-10(9)19/h4-8,11H,15H2,1-3H3.
What are the key properties of 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine?
2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine has a molecular weight of 271.32 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(5-pyrazolo[1,5-a]pyridin-3-yl-1,2,4-oxadiazol-3-yl)propan-1-amine is sourced from PubChem (CID 103121808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).