N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide

C19H22N4O2 — CID 31342976

IUPACN,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide
SMILESCc1ccccc1OCCN(C)C(=O)c1cnc2c(c1)c(C)nn2C
InChIInChI=1S/C19H22N4O2/c1-13-7-5-6-8-17(13)25-10-9-22(3)19(24)15-11-16-14(2)21-23(4)18(16)20-12-15/h5-8,11-12H,9-10H2,1-4H3
InChIKeyDPTPMLNLOLNALT-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.74
Rot. Bonds5

About N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide

N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide (PubChem CID 31342976) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide
PubChem CID31342976
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC NameN,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide
SMILESCc1ccccc1OCCN(C)C(=O)c1cnc2c(c1)c(C)nn2C
InChIInChI=1S/C19H22N4O2/c1-13-7-5-6-8-17(13)25-10-9-22(3)19(24)15-11-16-14(2)21-23(4)18(16)20-12-15/h5-8,11-12H,9-10H2,1-4H3
InChIKeyDPTPMLNLOLNALT-UHFFFAOYSA-N
XLogP2.74
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide?
The IUPAC name of N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide (CID 31342976) is N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide?
The canonical SMILES for N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide is Cc1ccccc1OCCN(C)C(=O)c1cnc2c(c1)c(C)nn2C.
What is the InChIKey of N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide?
The InChIKey is DPTPMLNLOLNALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-13-7-5-6-8-17(13)25-10-9-22(3)19(24)15-11-16-14(2)21-23(4)18(16)20-12-15/h5-8,11-12H,9-10H2,1-4H3.
What are the key properties of N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide?
N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.74, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-N-[2-(2-methylphenoxy)ethyl]pyrazolo[5,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 31342976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).