4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine

C17H25N3O — CID 151382459

IUPAC4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine
SMILESCc1cccc2c(CN3CCOCC3)nn(CC(C)C)c12
InChIInChI=1S/C17H25N3O/c1-13(2)11-20-17-14(3)5-4-6-15(17)16(18-20)12-19-7-9-21-10-8-19/h4-6,13H,7-12H2,1-3H3
InChIKeyOSSCADGCDJELDA-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.83
Rot. Bonds4

About 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine

4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine (PubChem CID 151382459) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine
PubChem CID151382459
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine
SMILESCc1cccc2c(CN3CCOCC3)nn(CC(C)C)c12
InChIInChI=1S/C17H25N3O/c1-13(2)11-20-17-14(3)5-4-6-15(17)16(18-20)12-19-7-9-21-10-8-19/h4-6,13H,7-12H2,1-3H3
InChIKeyOSSCADGCDJELDA-UHFFFAOYSA-N
XLogP2.83
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-[[7-chloro-1-(2-methylpropyl)-3-(morpholin-4-ylmethyl)indazol-6-yl]methoxy]phenyl]propanoic acid
CID 163577604
4-[(4-methyl-1-propan-2-ylindol-2-yl)methyl]morpholine
CID 117184909
ethane;4-[(2-methylphenyl)methyl]morpholine
CID 142083627
1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine
CID 10290980
4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine
CID 137499082
1-ethyl-3-(morpholin-4-ylmethyl)indol-7-amine
CID 117182338
3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[[3-(3-morpholin-4-ylpropanoylamino)phenyl]methyl]propanamide
CID 55887219
2-(3-ethyl-4-oxophthalazin-1-yl)-N-[(2R)-1-morpholin-4-ylbutan-2-yl]acetamide
CID 51593829
4-[2-(2,7-dimethylindol-1-yl)ethyl]morpholine
CID 19366801
4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]morpholine
CID 171130228
1,7-dimethyl-3-(pyrrolidin-1-ylmethyl)indole
CID 117186191
4-[3-(2,7-dimethyl-1-propylindol-3-yl)propyl]morpholine
CID 170871034

Frequently Asked Questions

What is the IUPAC name of 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine?
The IUPAC name of 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine (CID 151382459) is 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine.
What is the SMILES notation for 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine?
The canonical SMILES for 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine is Cc1cccc2c(CN3CCOCC3)nn(CC(C)C)c12.
What is the InChIKey of 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine?
The InChIKey is OSSCADGCDJELDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-13(2)11-20-17-14(3)5-4-6-15(17)16(18-20)12-19-7-9-21-10-8-19/h4-6,13H,7-12H2,1-3H3.
What are the key properties of 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine?
4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine has a molecular weight of 287.41 g/mol, XLogP of 2.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine is sourced from PubChem (CID 151382459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).