(2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide

C19H25N3O3 — CID 92632573

IUPAC(2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide
SMILESCc1ccc2c(c1)cc(C(=O)N1CCO[C@@](C)(C(=O)N(C)C)C1)n2C
InChIInChI=1S/C19H25N3O3/c1-13-6-7-15-14(10-13)11-16(21(15)5)17(23)22-8-9-25-19(2,12-22)18(24)20(3)4/h6-7,10-11H,8-9,12H2,1-5H3/t19-/m1/s1
InChIKeyHWNYJBWHAQCDQB-LJQANCHMSA-N
MW343.43 g/mol
LogP1.81
Rot. Bonds2

About (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide

(2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide (PubChem CID 92632573) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide
PubChem CID92632573
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name(2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide
SMILESCc1ccc2c(c1)cc(C(=O)N1CCO[C@@](C)(C(=O)N(C)C)C1)n2C
InChIInChI=1S/C19H25N3O3/c1-13-6-7-15-14(10-13)11-16(21(15)5)17(23)22-8-9-25-19(2,12-22)18(24)20(3)4/h6-7,10-11H,8-9,12H2,1-5H3/t19-/m1/s1
InChIKeyHWNYJBWHAQCDQB-LJQANCHMSA-N
XLogP1.81
TPSA54.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide?
The IUPAC name of (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide (CID 92632573) is (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide.
What is the SMILES notation for (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide?
The canonical SMILES for (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide is Cc1ccc2c(c1)cc(C(=O)N1CCO[C@@](C)(C(=O)N(C)C)C1)n2C.
What is the InChIKey of (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide?
The InChIKey is HWNYJBWHAQCDQB-LJQANCHMSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-13-6-7-15-14(10-13)11-16(21(15)5)17(23)22-8-9-25-19(2,12-22)18(24)20(3)4/h6-7,10-11H,8-9,12H2,1-5H3/t19-/m1/s1.
What are the key properties of (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide?
(2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 1.81, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide is sourced from PubChem (CID 92632573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).