N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide

C17H16ClN5O — CID 51101378

IUPACN-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1cnc2c(cnn2C2CCCC2)c1
InChIInChI=1S/C17H16ClN5O/c18-13-5-6-15(19-10-13)22-17(24)12-7-11-9-21-23(16(11)20-8-12)14-3-1-2-4-14/h5-10,14H,1-4H2,(H,19,22,24)
InChIKeyGZTPVAZCUKJCJL-UHFFFAOYSA-N
MW341.80 g/mol
LogP3.85
Rot. Bonds3

About N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide

N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 51101378) has the molecular formula C17H16ClN5O and a molecular weight of 341.80 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID51101378
Molecular FormulaC17H16ClN5O
Molecular Weight341.80 g/mol
Exact Mass341.10
IUPAC NameN-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1cnc2c(cnn2C2CCCC2)c1
InChIInChI=1S/C17H16ClN5O/c18-13-5-6-15(19-10-13)22-17(24)12-7-11-9-21-23(16(11)20-8-12)14-3-1-2-4-14/h5-10,14H,1-4H2,(H,19,22,24)
InChIKeyGZTPVAZCUKJCJL-UHFFFAOYSA-N
XLogP3.85
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.80
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-cyclopropylethyl)-N-(5-fluoro-2-pyridinyl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 154747674
(1-cyclopentylpyrazolo[3,4-b]pyridin-5-yl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 71880992
1-cyclopentyl-N-[3-[(2,6-dimethylbenzoyl)amino]-2-hydroxypropyl]pyrazolo[3,4-b]pyridine-5-carboxamide
CID 166394006
5-chloro-N-(5-chloro-2-pyridinyl)-2-[(1-cycloheptylpiperidin-4-yl)-methylamino]benzamide
CID 54010729
4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
1-(azepan-1-yl)-2-[4-(1-cyclopentylpyrazolo[3,4-b]pyridine-5-carbonyl)piperazin-1-yl]ethanone
CID 56829217
2-N,6-N-bis(5-chloro-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 3421113
N-(5-chloro-2-pyridinyl)-4-(1,1-dioxo-1,2-thiazolidin-2-yl)benzamide
CID 51250658
N-(5-chloro-2-pyridinyl)-1H-pyrazole-4-carboxamide
CID 43583033
1-benzyl-N-(4,5-dichloro-2-pyridinyl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 75468059
N-(5-chloro-2-pyridinyl)-1,3-benzodioxole-5-carboxamide
CID 952845
1-(5-chloro-2-pyridinyl)-3-[(E)-2-cyclopentylethenyl]urea
CID 108911970

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide (CID 51101378) is N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide is O=C(Nc1ccc(Cl)cn1)c1cnc2c(cnn2C2CCCC2)c1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is GZTPVAZCUKJCJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN5O/c18-13-5-6-15(19-10-13)22-17(24)12-7-11-9-21-23(16(11)20-8-12)14-3-1-2-4-14/h5-10,14H,1-4H2,(H,19,22,24).
What are the key properties of N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide?
N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 341.80 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-1-cyclopentylpyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 51101378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).