2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine

C26H32N6O2 — CID 162433735

IUPAC2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine
SMILESCOCOc1cc2nn(C)cc2cc1-c1ccc2nc(N3CC(C)(C)NC(C)(C)C3)ccc2n1
InChIInChI=1S/C26H32N6O2/c1-25(2)14-32(15-26(3,4)30-25)24-10-9-20-21(28-24)8-7-19(27-20)18-11-17-13-31(5)29-22(17)12-23(18)34-16-33-6/h7-13,30H,14-16H2,1-6H3
InChIKeyQEDNOEUYJWWKTD-UHFFFAOYSA-N
MW460.58 g/mol
LogP4.13
Rot. Bonds5

About 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine

2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine (PubChem CID 162433735) has the molecular formula C26H32N6O2 and a molecular weight of 460.58 g/mol. Its IUPAC name is 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine.

Molecular Properties

Compound Name2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine
PubChem CID162433735
Molecular FormulaC26H32N6O2
Molecular Weight460.58 g/mol
Exact Mass460.26
IUPAC Name2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine
SMILESCOCOc1cc2nn(C)cc2cc1-c1ccc2nc(N3CC(C)(C)NC(C)(C)C3)ccc2n1
InChIInChI=1S/C26H32N6O2/c1-25(2)14-32(15-26(3,4)30-25)24-10-9-20-21(28-24)8-7-19(27-20)18-11-17-13-31(5)29-22(17)12-23(18)34-16-33-6/h7-13,30H,14-16H2,1-6H3
InChIKeyQEDNOEUYJWWKTD-UHFFFAOYSA-N
XLogP4.13
TPSA77.33 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.58
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

tert-butyl 2-ethyl-4-[6-[6-(methoxymethoxy)-2-methylindazol-5-yl]-1,5-naphthyridin-2-yl]piperazine-1-carboxylate
CID 169082148
tert-butyl 7-[6-[6-(methoxymethoxy)-2-methylindazol-5-yl]-1,5-naphthyridin-2-yl]-4-azaspiro[2.5]oct-6-ene-4-carboxylate
CID 168978029
2-methyl-5-(6-piperazin-1-yl-1,5-naphthyridin-2-yl)indazol-6-ol
CID 162433567
sodium;2-methylpropane;2-methyl-5-(6-pyrrolidin-1-yl-1,5-naphthyridin-2-yl)indazol-6-ol
CID 168977232
tert-butyl 4-[5-[6-(methoxymethoxy)-2-methylindazol-5-yl]pyrazolo[4,3-b]pyridin-2-yl]piperidine-1-carboxylate
CID 168902520
N-tert-butyl-1-[6-[6-(methoxymethoxy)-2,7-dimethylindazol-5-yl]-1,5-naphthyridin-2-yl]pyrrolidin-3-amine
CID 162433469
5-[6-(1,7-diazaspiro[3.5]nonan-1-yl)-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 162433370
5-[6-[3-(cyclopropylamino)pyrrolidin-1-yl]-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 162433627
2-methyl-5-[6-[(3S)-3-(propan-2-ylamino)pyrrolidin-1-yl]-1,5-naphthyridin-2-yl]indazol-6-ol
CID 162433630
tert-butyl (2R,6S)-4-[8-fluoro-2-[6-(methoxymethoxy)-2-methylindazol-5-yl]quinolin-6-yl]-2,6-dimethylpiperazine-1-carboxylate
CID 168977509
6-(methoxymethoxy)-2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole
CID 162432959
5-[6-[(3R)-3-(tert-butylamino)pyrrolidin-1-yl]-1,5-naphthyridin-2-yl]-2-methylindazol-6-ol
CID 162433822

Frequently Asked Questions

What is the IUPAC name of 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine?
The IUPAC name of 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine (CID 162433735) is 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine.
What is the SMILES notation for 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine?
The canonical SMILES for 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine is COCOc1cc2nn(C)cc2cc1-c1ccc2nc(N3CC(C)(C)NC(C)(C)C3)ccc2n1.
What is the InChIKey of 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine?
The InChIKey is QEDNOEUYJWWKTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N6O2/c1-25(2)14-32(15-26(3,4)30-25)24-10-9-20-21(28-24)8-7-19(27-20)18-11-17-13-31(5)29-22(17)12-23(18)34-16-33-6/h7-13,30H,14-16H2,1-6H3.
What are the key properties of 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine?
2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine has a molecular weight of 460.58 g/mol, XLogP of 4.13, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(methoxymethoxy)-2-methylindazol-5-yl]-6-(3,3,5,5-tetramethylpiperazin-1-yl)-1,5-naphthyridine is sourced from PubChem (CID 162433735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).