N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine

C17H12ClN5O — CID 53374104

IUPACN-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESClc1cc(Nc2n[nH]c3cccnc23)ccc1Oc1ccccn1
InChIInChI=1S/C17H12ClN5O/c18-12-10-11(6-7-14(12)24-15-5-1-2-8-19-15)21-17-16-13(22-23-17)4-3-9-20-16/h1-10H,(H2,21,22,23)
InChIKeyYKLFCQRBEGYLSF-UHFFFAOYSA-N
MW337.77 g/mol
LogP4.54
Rot. Bonds4

About N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine

N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 53374104) has the molecular formula C17H12ClN5O and a molecular weight of 337.77 g/mol. Its IUPAC name is N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID53374104
Molecular FormulaC17H12ClN5O
Molecular Weight337.77 g/mol
Exact Mass337.07
IUPAC NameN-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESClc1cc(Nc2n[nH]c3cccnc23)ccc1Oc1ccccn1
InChIInChI=1S/C17H12ClN5O/c18-12-10-11(6-7-14(12)24-15-5-1-2-8-19-15)21-17-16-13(22-23-17)4-3-9-20-16/h1-10H,(H2,21,22,23)
InChIKeyYKLFCQRBEGYLSF-UHFFFAOYSA-N
XLogP4.54
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.77
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-3-(2-morpholin-4-ylethoxy)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11619972
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-3-[2-(4-methylpiperazin-1-yl)ethoxy]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11634645
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-3-(3-morpholin-4-ylpropoxy)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11663284
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-3-(2-piperazin-1-ylethoxy)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11518627
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-3-[3-(4-methylpiperazin-1-yl)propoxy]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11533556
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-3-(2-pyrrolidin-1-ylethoxy)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11561779
N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]-3-[2-(methylamino)ethoxy]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 11597061
5-[(4-aminopiperidin-1-yl)methyl]-N-[3-chloro-4-(pyridin-3-ylmethoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 11684098
5-[(4-aminopiperidin-1-yl)methyl]-N-[3-chloro-4-[(5-methyl-3-pyridinyl)methoxy]phenyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 22055240
5-[(4-aminopiperidin-1-yl)methyl]-N-(3-chloro-4-methoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 53322058
N-(3-Chloro-4-(pyridin-2-ylmethoxy)phenyl)-5H-pyrrolo[3,2-d]pyrimidin-4-amine
CID 56849555
N-[3-chloro-4-(3-fluorophenoxy)phenyl]-5H-pyrrolo[3,2-d]pyrimidin-4-amine
CID 56851428

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 53374104) is N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine is Clc1cc(Nc2n[nH]c3cccnc23)ccc1Oc1ccccn1.
What is the InChIKey of N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is YKLFCQRBEGYLSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClN5O/c18-12-10-11(6-7-14(12)24-15-5-1-2-8-19-15)21-17-16-13(22-23-17)4-3-9-20-16/h1-10H,(H2,21,22,23).
What are the key properties of N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 337.77 g/mol, XLogP of 4.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-pyridin-2-yloxyphenyl)-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 53374104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).