N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide

C24H25N7O2 — CID 117075458

IUPACN-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccnc(-n2ncc3cc(Nc4cccnc4)ccc32)c1
InChIInChI=1S/C24H25N7O2/c32-24(27-8-9-30-10-12-33-13-11-30)18-5-7-26-23(15-18)31-22-4-3-20(14-19(22)16-28-31)29-21-2-1-6-25-17-21/h1-7,14-17,29H,8-13H2,(H,27,32)
InChIKeySXMGEBLDJBCFCC-UHFFFAOYSA-N
MW443.51 g/mol
LogP2.62
Rot. Bonds7

About N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide

N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide (PubChem CID 117075458) has the molecular formula C24H25N7O2 and a molecular weight of 443.51 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide
PubChem CID117075458
Molecular FormulaC24H25N7O2
Molecular Weight443.51 g/mol
Exact Mass443.21
IUPAC NameN-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccnc(-n2ncc3cc(Nc4cccnc4)ccc32)c1
InChIInChI=1S/C24H25N7O2/c32-24(27-8-9-30-10-12-33-13-11-30)18-5-7-26-23(15-18)31-22-4-3-20(14-19(22)16-28-31)29-21-2-1-6-25-17-21/h1-7,14-17,29H,8-13H2,(H,27,32)
InChIKeySXMGEBLDJBCFCC-UHFFFAOYSA-N
XLogP2.62
TPSA97.20 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.51
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide with MolForge

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Related Compounds

3-[5-(3-methylanilino)indazol-1-yl]-N-(2-morpholin-4-ylethyl)benzamide
CID 117075307
2-[5-(3-chloroanilino)indazol-1-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-4-carboxamide;2,2,2-trifluoroacetic acid
CID 117075528
4-[5-(2,6-dichloroanilino)indazol-1-yl]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 71602865
3-[5-(2-fluoro-6-nitroanilino)indazol-1-yl]-N-(2-morpholin-4-ylethyl)benzamide
CID 117076085
3-[5-(2-chloroanilino)indazol-1-yl]-N-(3-morpholin-4-ylpropyl)benzamide
CID 71602771
2-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 109167956
4-(4-hydroxypiperidin-1-yl)-N-[1-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]indazol-5-yl]benzamide
CID 67112996
3-(5-anilinopyrazolo[3,4-b]pyridin-1-yl)-N-(2-morpholin-4-ylethyl)benzamide;2,2,2-trifluoroacetic acid
CID 117076338
5-(3,4-dimethylanilino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229512
2-methoxy-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 84580344
6-[5-(2-chloroanilino)indazol-1-yl]-N-[2-(4-methylpiperazin-1-yl)ethyl]pyridine-3-carboxamide
CID 117075597
N-(2-morpholin-4-ylethyl)-2-(4-morpholin-4-ylpiperidin-1-yl)pyridine-4-carboxamide
CID 117089399

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide (CID 117075458) is N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide is O=C(NCCN1CCOCC1)c1ccnc(-n2ncc3cc(Nc4cccnc4)ccc32)c1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide?
The InChIKey is SXMGEBLDJBCFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N7O2/c32-24(27-8-9-30-10-12-33-13-11-30)18-5-7-26-23(15-18)31-22-4-3-20(14-19(22)16-28-31)29-21-2-1-6-25-17-21/h1-7,14-17,29H,8-13H2,(H,27,32).
What are the key properties of N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide?
N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide has a molecular weight of 443.51 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-2-[5-(pyridin-3-ylamino)indazol-1-yl]pyridine-4-carboxamide is sourced from PubChem (CID 117075458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).