N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine

C14H16N4O — CID 55161070

IUPACN-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
SMILESCC(C)n1ncc2cc(NCc3ccoc3)cnc21
InChIInChI=1S/C14H16N4O/c1-10(2)18-14-12(7-17-18)5-13(8-16-14)15-6-11-3-4-19-9-11/h3-5,7-10,15H,6H2,1-2H3
InChIKeyZZEXYDBIORXRFY-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.22
Rot. Bonds4

About N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine

N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine (PubChem CID 55161070) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
PubChem CID55161070
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC NameN-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
SMILESCC(C)n1ncc2cc(NCc3ccoc3)cnc21
InChIInChI=1S/C14H16N4O/c1-10(2)18-14-12(7-17-18)5-13(8-16-14)15-6-11-3-4-19-9-11/h3-5,7-10,15H,6H2,1-2H3
InChIKeyZZEXYDBIORXRFY-UHFFFAOYSA-N
XLogP3.22
TPSA55.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-fluorophenyl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
CID 28683271
N-[(1-methylpyrazol-4-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
CID 28683322
N-[(2-methylpyrazol-3-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
CID 43663311
N-[(5-methylthiophen-2-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
CID 28683323
1-propan-2-yl-N-(1,3-thiazol-2-ylmethyl)pyrazolo[3,4-b]pyridin-5-amine
CID 63656201
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
CID 28781610
N-(1-methoxypropan-2-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
CID 62536786
N-(piperidin-4-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine
CID 79708149
1-[(4-methylphenyl)methyl]-3-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)urea
CID 47040136
N-[(1-propan-2-ylpyrazolo[5,4-b]pyridin-5-yl)methyl]-4-(trifluoromethyl)pyridin-2-amine
CID 99835539
5-chloro-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)furan-2-carboxamide
CID 30156254
N-(furan-3-ylmethyl)quinolin-6-amine
CID 63204697

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine?
The IUPAC name of N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine (CID 55161070) is N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine.
What is the SMILES notation for N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine?
The canonical SMILES for N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine is CC(C)n1ncc2cc(NCc3ccoc3)cnc21.
What is the InChIKey of N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine?
The InChIKey is ZZEXYDBIORXRFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-10(2)18-14-12(7-17-18)5-13(8-16-14)15-6-11-3-4-19-9-11/h3-5,7-10,15H,6H2,1-2H3.
What are the key properties of N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine?
N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine has a molecular weight of 256.31 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-amine is sourced from PubChem (CID 55161070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).