2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine

C15H18N4O — CID 29087891

IUPAC2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine
SMILESCc1cc(CN(C)CCc2[nH]nc3ccccc23)on1
InChIInChI=1S/C15H18N4O/c1-11-9-12(20-18-11)10-19(2)8-7-15-13-5-3-4-6-14(13)16-17-15/h3-6,9H,7-8,10H2,1-2H3,(H,16,17)
InChIKeyJWRJRCPRGIDYLB-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.53
Rot. Bonds5

About 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine

2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine (PubChem CID 29087891) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine
PubChem CID29087891
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine
SMILESCc1cc(CN(C)CCc2[nH]nc3ccccc23)on1
InChIInChI=1S/C15H18N4O/c1-11-9-12(20-18-11)10-19(2)8-7-15-13-5-3-4-6-14(13)16-17-15/h3-6,9H,7-8,10H2,1-2H3,(H,16,17)
InChIKeyJWRJRCPRGIDYLB-UHFFFAOYSA-N
XLogP2.53
TPSA57.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine?
The IUPAC name of 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine (CID 29087891) is 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine.
What is the SMILES notation for 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine?
The canonical SMILES for 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine is Cc1cc(CN(C)CCc2[nH]nc3ccccc23)on1.
What is the InChIKey of 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine?
The InChIKey is JWRJRCPRGIDYLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-11-9-12(20-18-11)10-19(2)8-7-15-13-5-3-4-6-14(13)16-17-15/h3-6,9H,7-8,10H2,1-2H3,(H,16,17).
What are the key properties of 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine?
2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine has a molecular weight of 270.34 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-indazol-3-yl)-N-methyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 29087891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).