N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane

C17H14ClF2N5O — CID 163220978

IUPACN-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane
SMILESCC.O=CNc1cc2cc(-c3c(Cl)c(F)c(F)c4[nH]ncc34)ccn2n1
InChIInChI=1S/C15H8ClF2N5O.C2H6/c16-12-11(9-5-20-21-15(9)14(18)13(12)17)7-1-2-23-8(3-7)4-10(22-23)19-6-24;1-2/h1-6H,(H,20,21)(H,19,22,24);1-2H3
InChIKeyIGCIUDXMXKEGDV-UHFFFAOYSA-N
MW377.78 g/mol
LogP4.40
Rot. Bonds3

About N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane

N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane (PubChem CID 163220978) has the molecular formula C17H14ClF2N5O and a molecular weight of 377.78 g/mol. Its IUPAC name is N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane.

Molecular Properties

Compound NameN-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane
PubChem CID163220978
Molecular FormulaC17H14ClF2N5O
Molecular Weight377.78 g/mol
Exact Mass377.09
IUPAC NameN-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane
SMILESCC.O=CNc1cc2cc(-c3c(Cl)c(F)c(F)c4[nH]ncc34)ccn2n1
InChIInChI=1S/C15H8ClF2N5O.C2H6/c16-12-11(9-5-20-21-15(9)14(18)13(12)17)7-1-2-23-8(3-7)4-10(22-23)19-6-24;1-2/h1-6H,(H,20,21)(H,19,22,24);1-2H3
InChIKeyIGCIUDXMXKEGDV-UHFFFAOYSA-N
XLogP4.40
TPSA75.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.78
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

N-[5-[5-chloro-6-fluoro-7-(2,2,2-trifluoro-1-hydroxyethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]formamide
CID 163220955
N-[1-[5-chloro-6-fluoro-4-(2-formamidopyrazolo[1,5-a]pyridin-5-yl)-1H-indazol-7-yl]ethyl]propanamide;cyclopropane
CID 163221498
N-[5-[7-[ethyl(methyl)amino]-6-fluoro-5-methylsulfanyl-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]formamide
CID 163221088
5-(6,7-difluoro-5-methyl-1H-indazol-4-yl)-N-methylpyrazolo[1,5-a]pyridin-2-amine
CID 167002328
fluoro N-[5-(7-acetamido-5-chloro-6-fluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]carbamate
CID 163220905
N-[5-(5-methoxy-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide
CID 163221136
N-[5-[5-chloro-6-fluoro-7-(fluoromethyl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 175707330
cis-(1S,2S)-N-[5-(5-chloro-6-fluoro-7-pyrrol-1-yl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 164520334
cis-(1S,2S)-N-[5-[5-chloro-6-fluoro-7-(3-fluoro-3-methylazetidin-1-yl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 164718290
N-[5-[7-[2-[carbamoyl(methyl)amino]ethoxy]-6-fluoro-5-methyl-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]formamide;cyclopropane
CID 163221482
cis-(1S,2S)-N-[5-(5-chloro-6-fluoro-7-pyrrolidin-1-yl-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 164718281
cis-(1S,2S)-N-[5-[5-chloro-6-fluoro-7-(4-oxopentan-2-yl)-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 165070262

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane?
The IUPAC name of N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane (CID 163220978) is N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane.
What is the SMILES notation for N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane?
The canonical SMILES for N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane is CC.O=CNc1cc2cc(-c3c(Cl)c(F)c(F)c4[nH]ncc34)ccn2n1.
What is the InChIKey of N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane?
The InChIKey is IGCIUDXMXKEGDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClF2N5O.C2H6/c16-12-11(9-5-20-21-15(9)14(18)13(12)17)7-1-2-23-8(3-7)4-10(22-23)19-6-24;1-2/h1-6H,(H,20,21)(H,19,22,24);1-2H3.
What are the key properties of N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane?
N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane has a molecular weight of 377.78 g/mol, XLogP of 4.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-chloro-6,7-difluoro-1H-indazol-4-yl)pyrazolo[1,5-a]pyridin-2-yl]formamide;ethane is sourced from PubChem (CID 163220978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).