1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine

C17H20N4 — CID 43725542

IUPAC1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1nn(C)c2ncc(NCC(C)c3ccccc3)cc12
InChIInChI=1S/C17H20N4/c1-12(14-7-5-4-6-8-14)10-18-15-9-16-13(2)20-21(3)17(16)19-11-15/h4-9,11-12,18H,10H2,1-3H3
InChIKeyRFNXIELOSPBHDG-UHFFFAOYSA-N
MW280.38 g/mol
LogP3.49
Rot. Bonds4

About 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine

1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine (PubChem CID 43725542) has the molecular formula C17H20N4 and a molecular weight of 280.38 g/mol. Its IUPAC name is 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine.

Molecular Properties

Compound Name1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine
PubChem CID43725542
Molecular FormulaC17H20N4
Molecular Weight280.38 g/mol
Exact Mass280.17
IUPAC Name1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1nn(C)c2ncc(NCC(C)c3ccccc3)cc12
InChIInChI=1S/C17H20N4/c1-12(14-7-5-4-6-8-14)10-18-15-9-16-13(2)20-21(3)17(16)19-11-15/h4-9,11-12,18H,10H2,1-3H3
InChIKeyRFNXIELOSPBHDG-UHFFFAOYSA-N
XLogP3.49
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine?
The IUPAC name of 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine (CID 43725542) is 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine.
What is the SMILES notation for 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine?
The canonical SMILES for 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine is Cc1nn(C)c2ncc(NCC(C)c3ccccc3)cc12.
What is the InChIKey of 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine?
The InChIKey is RFNXIELOSPBHDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4/c1-12(14-7-5-4-6-8-14)10-18-15-9-16-13(2)20-21(3)17(16)19-11-15/h4-9,11-12,18H,10H2,1-3H3.
What are the key properties of 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine?
1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine has a molecular weight of 280.38 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-(2-phenylpropyl)pyrazolo[5,4-b]pyridin-5-amine is sourced from PubChem (CID 43725542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).