N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide

C24H30N6O4 — CID 118182674

IUPACN-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide
SMILESCOc1cc2nn(CC(=O)N3CCOCC3)cc2cc1NC(=O)c1cccc(NCC(C)C)n1
InChIInChI=1S/C24H30N6O4/c1-16(2)13-25-22-6-4-5-18(26-22)24(32)27-20-11-17-14-30(28-19(17)12-21(20)33-3)15-23(31)29-7-9-34-10-8-29/h4-6,11-12,14,16H,7-10,13,15H2,1-3H3,(H,25,26)(H,27,32)
InChIKeyJYDDZHVWLDZGJX-UHFFFAOYSA-N
MW466.54 g/mol
LogP2.62
Rot. Bonds8

About N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide

N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide (PubChem CID 118182674) has the molecular formula C24H30N6O4 and a molecular weight of 466.54 g/mol. Its IUPAC name is N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide
PubChem CID118182674
Molecular FormulaC24H30N6O4
Molecular Weight466.54 g/mol
Exact Mass466.23
IUPAC NameN-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide
SMILESCOc1cc2nn(CC(=O)N3CCOCC3)cc2cc1NC(=O)c1cccc(NCC(C)C)n1
InChIInChI=1S/C24H30N6O4/c1-16(2)13-25-22-6-4-5-18(26-22)24(32)27-20-11-17-14-30(28-19(17)12-21(20)33-3)15-23(31)29-7-9-34-10-8-29/h4-6,11-12,14,16H,7-10,13,15H2,1-3H3,(H,25,26)(H,27,32)
InChIKeyJYDDZHVWLDZGJX-UHFFFAOYSA-N
XLogP2.62
TPSA110.61 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.54
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide?
The IUPAC name of N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide (CID 118182674) is N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide?
The canonical SMILES for N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide is COc1cc2nn(CC(=O)N3CCOCC3)cc2cc1NC(=O)c1cccc(NCC(C)C)n1.
What is the InChIKey of N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide?
The InChIKey is JYDDZHVWLDZGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O4/c1-16(2)13-25-22-6-4-5-18(26-22)24(32)27-20-11-17-14-30(28-19(17)12-21(20)33-3)15-23(31)29-7-9-34-10-8-29/h4-6,11-12,14,16H,7-10,13,15H2,1-3H3,(H,25,26)(H,27,32).
What are the key properties of N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide?
N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide has a molecular weight of 466.54 g/mol, XLogP of 2.62, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-6-(2-methylpropylamino)pyridine-2-carboxamide is sourced from PubChem (CID 118182674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).