2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide

C25H23N5O2 — CID 149104787

IUPAC2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
SMILESCn1ncc2cc(-c3cc(C(N)=O)c4c(n3)-c3ccc(N5CCOCC5)cc3C4)ccc21
InChIInChI=1S/C25H23N5O2/c1-29-23-5-2-15(10-17(23)14-27-29)22-13-21(25(26)31)20-12-16-11-18(30-6-8-32-9-7-30)3-4-19(16)24(20)28-22/h2-5,10-11,13-14H,6-9,12H2,1H3,(H2,26,31)
InChIKeyQVLCVQFTBYFWJK-UHFFFAOYSA-N
MW425.49 g/mol
LogP3.14
Rot. Bonds3

About 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide

2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide (PubChem CID 149104787) has the molecular formula C25H23N5O2 and a molecular weight of 425.49 g/mol. Its IUPAC name is 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
PubChem CID149104787
Molecular FormulaC25H23N5O2
Molecular Weight425.49 g/mol
Exact Mass425.19
IUPAC Name2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide
SMILESCn1ncc2cc(-c3cc(C(N)=O)c4c(n3)-c3ccc(N5CCOCC5)cc3C4)ccc21
InChIInChI=1S/C25H23N5O2/c1-29-23-5-2-15(10-17(23)14-27-29)22-13-21(25(26)31)20-12-16-11-18(30-6-8-32-9-7-30)3-4-19(16)24(20)28-22/h2-5,10-11,13-14H,6-9,12H2,1H3,(H2,26,31)
InChIKeyQVLCVQFTBYFWJK-UHFFFAOYSA-N
XLogP3.14
TPSA86.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
The IUPAC name of 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide (CID 149104787) is 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide.
What is the SMILES notation for 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
The canonical SMILES for 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide is Cn1ncc2cc(-c3cc(C(N)=O)c4c(n3)-c3ccc(N5CCOCC5)cc3C4)ccc21.
What is the InChIKey of 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
The InChIKey is QVLCVQFTBYFWJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O2/c1-29-23-5-2-15(10-17(23)14-27-29)22-13-21(25(26)31)20-12-16-11-18(30-6-8-32-9-7-30)3-4-19(16)24(20)28-22/h2-5,10-11,13-14H,6-9,12H2,1H3,(H2,26,31).
What are the key properties of 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide?
2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide has a molecular weight of 425.49 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindazol-5-yl)-7-morpholin-4-yl-5H-indeno[1,2-b]pyridine-4-carboxamide is sourced from PubChem (CID 149104787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).