2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide

C15H21N5O — CID 64822961

IUPAC2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide
SMILESCc1nn(C)c2ncc(NC(=O)C3CCCCC3N)cc12
InChIInChI=1S/C15H21N5O/c1-9-12-7-10(8-17-14(12)20(2)19-9)18-15(21)11-5-3-4-6-13(11)16/h7-8,11,13H,3-6,16H2,1-2H3,(H,18,21)
InChIKeyOMCQQVKWOGRTRZ-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.73
Rot. Bonds2

About 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide

2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide (PubChem CID 64822961) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide
PubChem CID64822961
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide
SMILESCc1nn(C)c2ncc(NC(=O)C3CCCCC3N)cc12
InChIInChI=1S/C15H21N5O/c1-9-12-7-10(8-17-14(12)20(2)19-9)18-15(21)11-5-3-4-6-13(11)16/h7-8,11,13H,3-6,16H2,1-2H3,(H,18,21)
InChIKeyOMCQQVKWOGRTRZ-UHFFFAOYSA-N
XLogP1.73
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-1-methylsulfonylpiperidine-4-carboxamide
CID 51334705
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-1-phenylpyrrolidine-2-carboxamide
CID 139009521
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 134042792
2-amino-N-(4,6-dimethyl-2H-pyrazolo[3,4-c]pyrazol-3-yl)cyclooctane-1-carboxamide
CID 137049990
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-1-methylcyclopentane-1-carboxamide
CID 134042789
3-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-1-methyl-1-(1-methylpiperidin-4-yl)urea
CID 136571775
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
CID 139000026
2-[1-(aminomethyl)cyclobutyl]-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)acetamide
CID 81171959
N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-methylsulfonylpropanamide
CID 47203922
2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)-2-ethylbutanamide
CID 79809258
2-amino-N-(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)cyclopentane-1-carboxamide
CID 64822861
N-cyclopropyl-1,3-dimethylpyrazolo[5,4-b]pyridin-5-amine
CID 103439052

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide (CID 64822961) is 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide is Cc1nn(C)c2ncc(NC(=O)C3CCCCC3N)cc12.
What is the InChIKey of 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide?
The InChIKey is OMCQQVKWOGRTRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-9-12-7-10(8-17-14(12)20(2)19-9)18-15(21)11-5-3-4-6-13(11)16/h7-8,11,13H,3-6,16H2,1-2H3,(H,18,21).
What are the key properties of 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide?
2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 1.73, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 64822961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).