N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

C18H16F2N6O — CID 134192153

IUPACN-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCn1nc(OCC2CC2(F)F)c2ccc(Nc3n[nH]c4cccnc34)cc21
InChIInChI=1S/C18H16F2N6O/c1-26-14-7-11(22-16-15-13(23-24-16)3-2-6-21-15)4-5-12(14)17(25-26)27-9-10-8-18(10,19)20/h2-7,10H,8-9H2,1H3,(H2,22,23,24)
InChIKeyPDAZOYRJWFTJJN-UHFFFAOYSA-N
MW370.36 g/mol
LogP3.62
Rot. Bonds5

About N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 134192153) has the molecular formula C18H16F2N6O and a molecular weight of 370.36 g/mol. Its IUPAC name is N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID134192153
Molecular FormulaC18H16F2N6O
Molecular Weight370.36 g/mol
Exact Mass370.14
IUPAC NameN-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCn1nc(OCC2CC2(F)F)c2ccc(Nc3n[nH]c4cccnc34)cc21
InChIInChI=1S/C18H16F2N6O/c1-26-14-7-11(22-16-15-13(23-24-16)3-2-6-21-15)4-5-12(14)17(25-26)27-9-10-8-18(10,19)20/h2-7,10H,8-9H2,1H3,(H2,22,23,24)
InChIKeyPDAZOYRJWFTJJN-UHFFFAOYSA-N
XLogP3.62
TPSA80.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.36
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-methyl-3-propan-2-yloxyindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134191965
N-[1-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methoxy]indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134191976
N-[1-methyl-3-(2-methylpropoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134192062
N-[1-methyl-3-(oxan-4-yloxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134192169
N-[1-methyl-3-(oxan-2-ylmethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134198051
N-[1-methyl-3-(1-methylpiperidin-4-yl)oxyindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 134192002
4-phenylmethoxy-N-pyridin-3-yl-1H-indazol-3-amine
CID 139409540
3-[3-[(2,2-difluorocyclopropyl)methyl]benzimidazol-5-yl]-4-(oxan-4-yloxy)-1H-pyrazolo[4,3-c]pyridine
CID 66828859
4-(oxan-4-yloxy)-N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazolo[4,3-c]pyridin-3-amine
CID 66829063
1-[3-(2,2-difluoroethoxy)-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-[(3R,4S)-4-phenyl-1-propan-2-ylpyrrolidin-3-yl]urea
CID 76071086
1-[3-(2,2-difluoroethoxy)-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-[(3R,4S)-1-(2-methylpropyl)-4-phenylpyrrolidin-3-yl]urea
CID 76071089
1-[3-(2,2-difluoroethoxy)-1H-pyrazolo[4,3-c]pyridin-6-yl]-3-[(3R,4S)-4-phenyl-1-propylpyrrolidin-3-yl]urea
CID 76071090

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 134192153) is N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is Cn1nc(OCC2CC2(F)F)c2ccc(Nc3n[nH]c4cccnc34)cc21.
What is the InChIKey of N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is PDAZOYRJWFTJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16F2N6O/c1-26-14-7-11(22-16-15-13(23-24-16)3-2-6-21-15)4-5-12(14)17(25-26)27-9-10-8-18(10,19)20/h2-7,10H,8-9H2,1H3,(H2,22,23,24).
What are the key properties of N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 370.36 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2,2-difluorocyclopropyl)methoxy]-1-methylindazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 134192153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).