N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide

C14H14N4O2 — CID 99974348

IUPACN-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide
SMILESC[C@@H](c1ccon1)N(C)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H14N4O2/c1-9(11-7-8-20-17-11)18(2)14(19)13-10-5-3-4-6-12(10)15-16-13/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1
InChIKeyRSHWJNWMTUUWBJ-VIFPVBQESA-N
MW270.29 g/mol
LogP2.38
Rot. Bonds3

About N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide

N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide (PubChem CID 99974348) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide
PubChem CID99974348
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC NameN-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide
SMILESC[C@@H](c1ccon1)N(C)C(=O)c1n[nH]c2ccccc12
InChIInChI=1S/C14H14N4O2/c1-9(11-7-8-20-17-11)18(2)14(19)13-10-5-3-4-6-12(10)15-16-13/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1
InChIKeyRSHWJNWMTUUWBJ-VIFPVBQESA-N
XLogP2.38
TPSA75.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide (CID 99974348) is N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide is C[C@@H](c1ccon1)N(C)C(=O)c1n[nH]c2ccccc12.
What is the InChIKey of N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide?
The InChIKey is RSHWJNWMTUUWBJ-VIFPVBQESA-N. The full InChI is InChI=1S/C14H14N4O2/c1-9(11-7-8-20-17-11)18(2)14(19)13-10-5-3-4-6-12(10)15-16-13/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1.
What are the key properties of N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide?
N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 99974348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).