N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide

C25H23F2N5O2 — CID 150734148

IUPACN-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide
SMILESCn1cc2ccc(NC(=O)c3ccccn3)c(N3CCC(Oc4ccc(F)cc4F)CC3)c2n1
InChIInChI=1S/C25H23F2N5O2/c1-31-15-16-5-7-20(29-25(33)21-4-2-3-11-28-21)24(23(16)30-31)32-12-9-18(10-13-32)34-22-8-6-17(26)14-19(22)27/h2-8,11,14-15,18H,9-10,12-13H2,1H3,(H,29,33)
InChIKeyJSLTZCCRVAOOPA-UHFFFAOYSA-N
MW463.49 g/mol
LogP4.55
Rot. Bonds5

About N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide

N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide (PubChem CID 150734148) has the molecular formula C25H23F2N5O2 and a molecular weight of 463.49 g/mol. Its IUPAC name is N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide
PubChem CID150734148
Molecular FormulaC25H23F2N5O2
Molecular Weight463.49 g/mol
Exact Mass463.18
IUPAC NameN-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide
SMILESCn1cc2ccc(NC(=O)c3ccccn3)c(N3CCC(Oc4ccc(F)cc4F)CC3)c2n1
InChIInChI=1S/C25H23F2N5O2/c1-31-15-16-5-7-20(29-25(33)21-4-2-3-11-28-21)24(23(16)30-31)32-12-9-18(10-13-32)34-22-8-6-17(26)14-19(22)27/h2-8,11,14-15,18H,9-10,12-13H2,1H3,(H,29,33)
InChIKeyJSLTZCCRVAOOPA-UHFFFAOYSA-N
XLogP4.55
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.49
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide with MolForge

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Related Compounds

US9951086, Example 68
CID 118173098
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-(6-propan-2-yloxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 118381715
US9951086, Example 220
CID 118172527
US9951086, Example 46
CID 118172648
US9951086, Example 69
CID 118172658
US9951086, Example 221
CID 118172833
US9951086, Example 65
CID 118173075
US9951086, Example 64
CID 118173110
US9951086, Example 255
CID 118173137
US9951086, Example 71
CID 122637001
US9951086, Example 257
CID 122637024
US10435396, Example 4
CID 137377410

Frequently Asked Questions

What is the IUPAC name of N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide?
The IUPAC name of N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide (CID 150734148) is N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide is Cn1cc2ccc(NC(=O)c3ccccn3)c(N3CCC(Oc4ccc(F)cc4F)CC3)c2n1.
What is the InChIKey of N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide?
The InChIKey is JSLTZCCRVAOOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23F2N5O2/c1-31-15-16-5-7-20(29-25(33)21-4-2-3-11-28-21)24(23(16)30-31)32-12-9-18(10-13-32)34-22-8-6-17(26)14-19(22)27/h2-8,11,14-15,18H,9-10,12-13H2,1H3,(H,29,33).
What are the key properties of N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide?
N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide has a molecular weight of 463.49 g/mol, XLogP of 4.55, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-[4-(2,4-difluorophenoxy)piperidin-1-yl]-2-methylindazol-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 150734148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).