1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine

C11H16N4O — CID 83889501

IUPAC1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine
SMILESCOc1c(CC(C)N)cnc2c1cnn2C
InChIInChI=1S/C11H16N4O/c1-7(12)4-8-5-13-11-9(10(8)16-3)6-14-15(11)2/h5-7H,4,12H2,1-3H3
InChIKeyPWEAHDOVSOTDOV-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.87
Rot. Bonds3

About 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine

1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine (PubChem CID 83889501) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine
PubChem CID83889501
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine
SMILESCOc1c(CC(C)N)cnc2c1cnn2C
InChIInChI=1S/C11H16N4O/c1-7(12)4-8-5-13-11-9(10(8)16-3)6-14-15(11)2/h5-7H,4,12H2,1-3H3
InChIKeyPWEAHDOVSOTDOV-UHFFFAOYSA-N
XLogP0.87
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)butan-2-amine
CID 63197046
4-methoxy-10-methyl-3,5,6,8,10,11-hexazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaene
CID 19571476
4-(3-chlorobutan-2-yl)-1-methylpyrazolo[3,4-d]pyrimidine
CID 63203147
3-[(2R)-2-aminopropyl]-7-methylpyrazolo[5,4-d]triazin-4-one
CID 103934867
2-N-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)propane-1,2-diamine
CID 63730898
N-(1-anilinopropan-2-yl)-4-methoxy-1-methylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 75503967
ethane;1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 143264470
1-methyl-4-(3-methylbutan-2-yl)pyrazolo[3,4-d]pyrimidine
CID 163990677
2-N-methyl-2-N-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)propane-1,2-diamine
CID 83837840
(3-methylthiophen-2-yl)methyl 4-methoxy-1-methylpyrazolo[3,4-b]pyridine-5-carboxylate
CID 154752453
N-[(2-chlorophenyl)methyl]-4-methoxy-1-methylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 136529821
1-(4-methoxy-1-methylpyrazol-5-yl)-2-methylbutan-1-amine
CID 114651682

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine?
The IUPAC name of 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine (CID 83889501) is 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine.
What is the SMILES notation for 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine?
The canonical SMILES for 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine is COc1c(CC(C)N)cnc2c1cnn2C.
What is the InChIKey of 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine?
The InChIKey is PWEAHDOVSOTDOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-7(12)4-8-5-13-11-9(10(8)16-3)6-14-15(11)2/h5-7H,4,12H2,1-3H3.
What are the key properties of 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine?
1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine has a molecular weight of 220.28 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-1-methylpyrazolo[3,4-b]pyridin-5-yl)propan-2-amine is sourced from PubChem (CID 83889501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).