4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide

C15H21N5O — CID 11818535

IUPAC4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCCCCCn1ncc2c(N)c(C(=O)NC3CC3)cnc21
InChIInChI=1S/C15H21N5O/c1-2-3-4-7-20-14-11(9-18-20)13(16)12(8-17-14)15(21)19-10-5-6-10/h8-10H,2-7H2,1H3,(H2,16,17)(H,19,21)
InChIKeyJQKRNYRISDVWSM-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.10
Rot. Bonds6

About 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide

4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 11818535) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID11818535
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCCCCCn1ncc2c(N)c(C(=O)NC3CC3)cnc21
InChIInChI=1S/C15H21N5O/c1-2-3-4-7-20-14-11(9-18-20)13(16)12(8-17-14)15(21)19-10-5-6-10/h8-10H,2-7H2,1H3,(H2,16,17)(H,19,21)
InChIKeyJQKRNYRISDVWSM-UHFFFAOYSA-N
XLogP2.10
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Cartazolate
CID 37015
1-ethyl-N-(phenylmethyl)-4-(tetrahydro-2H-pyran-4-ylamino)-1H-pyrazolo(3,4-b)pyridine-5-carboxamide
CID 9821178
Msc2032964A
CID 25214468
(R)-N-(2-fluoro-3-hydroxy-3-methylbutyl)-6-((6-fluoropyrazolo[1,5-a]pyrimidin-5-yl)amino)-4-(isopropylamino)nicotinamide
CID 90155351
N-cyclopropyl-5-(3,5-dimethylanilino)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137441548
6-cyclopropyl-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
CID 9269197
(R)-6-(5-Cyano-1H-pyrazolo[3,4-b]pyridin-1-yl)-N-(2-fluoro-3-hydroxy-3-methylbutyl)-4-(isopropylamino)nicotinamide
CID 118206002
4-Amino-1-(3-pentyn-1-yl)-N-2-propen-1-yl-1H-pyrazolo(3,4-b)pyridine-5-carboxamide
CID 128415
6-Cyclopropyl-N-(2-(dimethylamino)ethyl)-1-isopropyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
CID 9503864
4-amino-1-pentyl-N-propylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 10017063
[1-Ethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]-pyrrolidin-1-ylmethanone
CID 10043075
4-amino-1-pent-4-ynyl-N-prop-2-enylpyrazolo[3,4-b]pyridine-5-carboxamide
CID 10085234

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide (CID 11818535) is 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide is CCCCCn1ncc2c(N)c(C(=O)NC3CC3)cnc21.
What is the InChIKey of 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is JQKRNYRISDVWSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-2-3-4-7-20-14-11(9-18-20)13(16)12(8-17-14)15(21)19-10-5-6-10/h8-10H,2-7H2,1H3,(H2,16,17)(H,19,21).
What are the key properties of 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide?
4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-1-pentylpyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 11818535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).