(2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide

C18H21F3N4O3 — CID 70708257

IUPAC(2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide
SMILESO=C(Nc1nn(CC(F)(F)F)c2cccc(N3CCOCC3)c12)[C@H]1CCCO1
InChIInChI=1S/C18H21F3N4O3/c19-18(20,21)11-25-13-4-1-3-12(24-6-9-27-10-7-24)15(13)16(23-25)22-17(26)14-5-2-8-28-14/h1,3-4,14H,2,5-11H2,(H,22,23,26)/t14-/m1/s1
InChIKeyFBKPCMYHYXGGSE-CQSZACIVSA-N
MW398.39 g/mol
LogP2.55
Rot. Bonds4

About (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide

(2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide (PubChem CID 70708257) has the molecular formula C18H21F3N4O3 and a molecular weight of 398.39 g/mol. Its IUPAC name is (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide
PubChem CID70708257
Molecular FormulaC18H21F3N4O3
Molecular Weight398.39 g/mol
Exact Mass398.16
IUPAC Name(2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide
SMILESO=C(Nc1nn(CC(F)(F)F)c2cccc(N3CCOCC3)c12)[C@H]1CCCO1
InChIInChI=1S/C18H21F3N4O3/c19-18(20,21)11-25-13-4-1-3-12(24-6-9-27-10-7-24)15(13)16(23-25)22-17(26)14-5-2-8-28-14/h1,3-4,14H,2,5-11H2,(H,22,23,26)/t14-/m1/s1
InChIKeyFBKPCMYHYXGGSE-CQSZACIVSA-N
XLogP2.55
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.39
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-N-[1-(4-fluorophenyl)-4-morpholin-4-ylindazol-3-yl]oxolane-3-carboxamide
CID 95894266
N-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]oxolane-2-carboxamide
CID 113000271
(2R)-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
CID 2476290
N-[3-[(2-morpholin-4-ylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 55542414
(2R)-N-[(3-fluoro-4-morpholin-4-ylphenyl)methyl]oxolane-2-carboxamide
CID 94616637
(2S)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]oxolane-2-carboxamide
CID 39964639
N-[2-(4-morpholin-4-ylphenyl)-2-oxoethyl]oxolane-2-carboxamide
CID 84580144
N-[(4-morpholin-4-ylphenyl)methyl]oxolane-2-carboxamide
CID 110405121
N-[6-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl]oxolane-2-carboxamide
CID 113043707
N-(2,6-dimethylphenyl)oxolane-2-carboxamide
CID 3155119
3-[[(2S)-oxolane-2-carbonyl]amino]benzoic acid
CID 839554
(2S)-N-[3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 7027817

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide (CID 70708257) is (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide is O=C(Nc1nn(CC(F)(F)F)c2cccc(N3CCOCC3)c12)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide?
The InChIKey is FBKPCMYHYXGGSE-CQSZACIVSA-N. The full InChI is InChI=1S/C18H21F3N4O3/c19-18(20,21)11-25-13-4-1-3-12(24-6-9-27-10-7-24)15(13)16(23-25)22-17(26)14-5-2-8-28-14/h1,3-4,14H,2,5-11H2,(H,22,23,26)/t14-/m1/s1.
What are the key properties of (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide?
(2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide has a molecular weight of 398.39 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[4-morpholin-4-yl-1-(2,2,2-trifluoroethyl)indazol-3-yl]oxolane-2-carboxamide is sourced from PubChem (CID 70708257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).