(2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide

C15H16FN3O3 — CID 124990260

IUPAC(2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide
SMILESC[C@]1(C(N)=O)CN(C(=O)c2cc3cccc(F)c3[nH]2)CCO1
InChIInChI=1S/C15H16FN3O3/c1-15(14(17)21)8-19(5-6-22-15)13(20)11-7-9-3-2-4-10(16)12(9)18-11/h2-4,7,18H,5-6,8H2,1H3,(H2,17,21)/t15-/m1/s1
InChIKeyPANHBHUWHHMEPB-OAHLLOKOSA-N
MW305.31 g/mol
LogP1.02
Rot. Bonds2

About (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide

(2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide (PubChem CID 124990260) has the molecular formula C15H16FN3O3 and a molecular weight of 305.31 g/mol. Its IUPAC name is (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide
PubChem CID124990260
Molecular FormulaC15H16FN3O3
Molecular Weight305.31 g/mol
Exact Mass305.12
IUPAC Name(2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide
SMILESC[C@]1(C(N)=O)CN(C(=O)c2cc3cccc(F)c3[nH]2)CCO1
InChIInChI=1S/C15H16FN3O3/c1-15(14(17)21)8-19(5-6-22-15)13(20)11-7-9-3-2-4-10(16)12(9)18-11/h2-4,7,18H,5-6,8H2,1H3,(H2,17,21)/t15-/m1/s1
InChIKeyPANHBHUWHHMEPB-OAHLLOKOSA-N
XLogP1.02
TPSA88.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.31
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide?
The IUPAC name of (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide (CID 124990260) is (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide.
What is the SMILES notation for (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide?
The canonical SMILES for (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide is C[C@]1(C(N)=O)CN(C(=O)c2cc3cccc(F)c3[nH]2)CCO1.
What is the InChIKey of (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide?
The InChIKey is PANHBHUWHHMEPB-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H16FN3O3/c1-15(14(17)21)8-19(5-6-22-15)13(20)11-7-9-3-2-4-10(16)12(9)18-11/h2-4,7,18H,5-6,8H2,1H3,(H2,17,21)/t15-/m1/s1.
What are the key properties of (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide?
(2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide has a molecular weight of 305.31 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(7-fluoro-1H-indole-2-carbonyl)-2-methylmorpholine-2-carboxamide is sourced from PubChem (CID 124990260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).