(3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide

C17H20F3N3O3 — CID 95897870

IUPAC(3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide
SMILESCC(C)Oc1ccc2c(NC(=O)[C@@H]3CCOC3)nn(CC(F)(F)F)c2c1
InChIInChI=1S/C17H20F3N3O3/c1-10(2)26-12-3-4-13-14(7-12)23(9-17(18,19)20)22-15(13)21-16(24)11-5-6-25-8-11/h3-4,7,10-11H,5-6,8-9H2,1-2H3,(H,21,22,24)/t11-/m1/s1
InChIKeyMYTZGBKRVNXIPL-LLVKDONJSA-N
MW371.36 g/mol
LogP3.36
Rot. Bonds5

About (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide

(3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide (PubChem CID 95897870) has the molecular formula C17H20F3N3O3 and a molecular weight of 371.36 g/mol. Its IUPAC name is (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide
PubChem CID95897870
Molecular FormulaC17H20F3N3O3
Molecular Weight371.36 g/mol
Exact Mass371.15
IUPAC Name(3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide
SMILESCC(C)Oc1ccc2c(NC(=O)[C@@H]3CCOC3)nn(CC(F)(F)F)c2c1
InChIInChI=1S/C17H20F3N3O3/c1-10(2)26-12-3-4-13-14(7-12)23(9-17(18,19)20)22-15(13)21-16(24)11-5-6-25-8-11/h3-4,7,10-11H,5-6,8-9H2,1-2H3,(H,21,22,24)/t11-/m1/s1
InChIKeyMYTZGBKRVNXIPL-LLVKDONJSA-N
XLogP3.36
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide with MolForge

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Related Compounds

1-ethyl-5-oxo-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]pyrrolidine-3-carboxamide
CID 70776276
3-ethyl-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]-1,2-oxazole-5-carboxamide
CID 70761670
(2R)-2-(4-methylpyrazol-1-yl)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]propanamide
CID 95867189
N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-2-methylpyrazole-3-carboxamide
CID 70760119
(3S)-N-[(1S)-1-[4-(trifluoromethoxy)phenyl]ethyl]oxolane-3-carboxamide
CID 94824757
N-(1-methyl-3-propan-2-yloxyindazol-5-yl)oxane-4-carboxamide
CID 100830658
N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)pyrazine-2-carboxamide
CID 70734149
N-[[1-methyl-5-(trifluoromethyl)benzimidazol-2-yl]methyl]oxolane-3-carboxamide
CID 118778674
N-[2-[(3,4-dimethoxyphenyl)methyl]-5-methylpyrazol-3-yl]oxolane-3-carboxamide
CID 155910818
N-[3-tert-butyl-1-(4-fluorophenyl)pyrazol-5-yl]oxolane-3-carboxamide
CID 75921275
(3R)-N-(5-methyl-1,2-oxazol-3-yl)oxolane-3-carboxamide
CID 27242204
(2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide
CID 70708257

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide?
The IUPAC name of (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide (CID 95897870) is (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide.
What is the SMILES notation for (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide?
The canonical SMILES for (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide is CC(C)Oc1ccc2c(NC(=O)[C@@H]3CCOC3)nn(CC(F)(F)F)c2c1.
What is the InChIKey of (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide?
The InChIKey is MYTZGBKRVNXIPL-LLVKDONJSA-N. The full InChI is InChI=1S/C17H20F3N3O3/c1-10(2)26-12-3-4-13-14(7-12)23(9-17(18,19)20)22-15(13)21-16(24)11-5-6-25-8-11/h3-4,7,10-11H,5-6,8-9H2,1-2H3,(H,21,22,24)/t11-/m1/s1.
What are the key properties of (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide?
(3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide has a molecular weight of 371.36 g/mol, XLogP of 3.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-3-carboxamide is sourced from PubChem (CID 95897870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).