N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide

C17H16N4O2 — CID 135435013

IUPACN-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide
SMILESCc1cc2c(NC(=O)C3CC3)n[nH]c2nc1-c1ccc(O)cc1
InChIInChI=1S/C17H16N4O2/c1-9-8-13-15(18-14(9)10-4-6-12(22)7-5-10)20-21-16(13)19-17(23)11-2-3-11/h4-8,11,22H,2-3H2,1H3,(H2,18,19,20,21,23)
InChIKeyBGVFZHIFEQILLB-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.99
Rot. Bonds3

About N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide

N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide (PubChem CID 135435013) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide
PubChem CID135435013
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC NameN-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide
SMILESCc1cc2c(NC(=O)C3CC3)n[nH]c2nc1-c1ccc(O)cc1
InChIInChI=1S/C17H16N4O2/c1-9-8-13-15(18-14(9)10-4-6-12(22)7-5-10)20-21-16(13)19-17(23)11-2-3-11/h4-8,11,22H,2-3H2,1H3,(H2,18,19,20,21,23)
InChIKeyBGVFZHIFEQILLB-UHFFFAOYSA-N
XLogP2.99
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-bromo-6-(4-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 135435011
N-[5-chloro-6-(4-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 135435012
N-(5-bromo-6-(4-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)-1-methylpiperidine-4-carboxamide
CID 135435015
N-[6-(3-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 6539569
N-[6-(3-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 6539570
4-(4-ethylpiperazin-1-yl)-N-[6-(3-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]butanamide
CID 6539585
N-[5-bromo-6-(4-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-4-(4-ethylpiperazin-1-yl)butanamide
CID 135416046
N-[6-(4-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 135435008
N-[6-(3,4-dihydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 135435009
N-[6-(2-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 135435010
N-[6-(4-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-1-methylpiperidine-4-carboxamide
CID 135435014
N-[6-(3-bromo-4-hydroxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 135435016

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide (CID 135435013) is N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide is Cc1cc2c(NC(=O)C3CC3)n[nH]c2nc1-c1ccc(O)cc1.
What is the InChIKey of N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
The InChIKey is BGVFZHIFEQILLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-9-8-13-15(18-14(9)10-4-6-12(22)7-5-10)20-21-16(13)19-17(23)11-2-3-11/h4-8,11,22H,2-3H2,1H3,(H2,18,19,20,21,23).
What are the key properties of N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide?
N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide has a molecular weight of 308.34 g/mol, XLogP of 2.99, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-hydroxyphenyl)-5-methyl-1H-pyrazolo[5,4-b]pyridin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 135435013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).