4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine

C21H20N4O2 — CID 150873063

IUPAC4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine
SMILESCOCc1nn(-c2ccccc2)c2c(OCc3ccnc(N)c3)cccc12
InChIInChI=1S/C21H20N4O2/c1-26-14-18-17-8-5-9-19(27-13-15-10-11-23-20(22)12-15)21(17)25(24-18)16-6-3-2-4-7-16/h2-12H,13-14H2,1H3,(H2,22,23)
InChIKeyKULFQULSYSTJCD-UHFFFAOYSA-N
MW360.42 g/mol
LogP3.73
Rot. Bonds6

About 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine

4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine (PubChem CID 150873063) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine
PubChem CID150873063
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC Name4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine
SMILESCOCc1nn(-c2ccccc2)c2c(OCc3ccnc(N)c3)cccc12
InChIInChI=1S/C21H20N4O2/c1-26-14-18-17-8-5-9-19(27-13-15-10-11-23-20(22)12-15)21(17)25(24-18)16-6-3-2-4-7-16/h2-12H,13-14H2,1H3,(H2,22,23)
InChIKeyKULFQULSYSTJCD-UHFFFAOYSA-N
XLogP3.73
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2-amino-4-pyridinyl)methyl]-3-(methoxymethyl)-1-phenylindazole-6-carboxamide
CID 150036852
4-[(2,6-dimethoxyphenoxy)methyl]pyridin-2-amine
CID 62464577
4-[(2-phenylphenoxy)methyl]pyridin-2-amine
CID 62464761
4-[(2-fluorophenoxy)methyl]pyridin-2-amine
CID 62464594
4-[(2-phenylpyrazol-3-yl)methyl]pyridin-2-amine
CID 107331174
2-[(2-amino-4-pyridinyl)methoxy]benzamide
CID 62463915
4-[(4-phenylphenoxy)methyl]pyridin-2-amine
CID 62466234
4-[(2-chloro-4-fluorophenoxy)methyl]pyridin-2-amine
CID 62465698
1-[4-[(2-amino-4-pyridinyl)methoxy]naphthalen-1-yl]-3-[3-tert-butyl-1-(4-methoxyphenyl)pyrazol-5-yl]urea
CID 163654484
4-[(2,4-difluorophenoxy)methyl]pyridin-2-amine
CID 62464402
2-[3-(methoxymethyl)phenyl]triazol-4-amine
CID 116799278
4-[(2,3,6-trimethylphenoxy)methyl]pyridin-2-amine
CID 62464982

Frequently Asked Questions

What is the IUPAC name of 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine?
The IUPAC name of 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine (CID 150873063) is 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine.
What is the SMILES notation for 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine?
The canonical SMILES for 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine is COCc1nn(-c2ccccc2)c2c(OCc3ccnc(N)c3)cccc12.
What is the InChIKey of 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine?
The InChIKey is KULFQULSYSTJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c1-26-14-18-17-8-5-9-19(27-13-15-10-11-23-20(22)12-15)21(17)25(24-18)16-6-3-2-4-7-16/h2-12H,13-14H2,1H3,(H2,22,23).
What are the key properties of 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine?
4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine has a molecular weight of 360.42 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[3-(methoxymethyl)-1-phenylindazol-7-yl]oxymethyl]pyridin-2-amine is sourced from PubChem (CID 150873063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).