(6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide

C20H26N6O3 — CID 97360918

IUPAC(6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
SMILESCCN(CC)C(=O)[C@H]1Cn2ccnc2C2(CCN(C(=O)c3ccnnc3)CC2)O1
InChIInChI=1S/C20H26N6O3/c1-3-24(4-2)18(28)16-14-26-12-9-21-19(26)20(29-16)6-10-25(11-7-20)17(27)15-5-8-22-23-13-15/h5,8-9,12-13,16H,3-4,6-7,10-11,14H2,1-2H3/t16-/m1/s1
InChIKeyGHDITCYCASBWDH-MRXNPFEDSA-N
MW398.47 g/mol
LogP1.07
Rot. Bonds4

About (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide

(6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide (PubChem CID 97360918) has the molecular formula C20H26N6O3 and a molecular weight of 398.47 g/mol. Its IUPAC name is (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide.

Molecular Properties

Compound Name(6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
PubChem CID97360918
Molecular FormulaC20H26N6O3
Molecular Weight398.47 g/mol
Exact Mass398.21
IUPAC Name(6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide
SMILESCCN(CC)C(=O)[C@H]1Cn2ccnc2C2(CCN(C(=O)c3ccnnc3)CC2)O1
InChIInChI=1S/C20H26N6O3/c1-3-24(4-2)18(28)16-14-26-12-9-21-19(26)20(29-16)6-10-25(11-7-20)17(27)15-5-8-22-23-13-15/h5,8-9,12-13,16H,3-4,6-7,10-11,14H2,1-2H3/t16-/m1/s1
InChIKeyGHDITCYCASBWDH-MRXNPFEDSA-N
XLogP1.07
TPSA93.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
The IUPAC name of (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide (CID 97360918) is (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide.
What is the SMILES notation for (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
The canonical SMILES for (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide is CCN(CC)C(=O)[C@H]1Cn2ccnc2C2(CCN(C(=O)c3ccnnc3)CC2)O1.
What is the InChIKey of (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
The InChIKey is GHDITCYCASBWDH-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H26N6O3/c1-3-24(4-2)18(28)16-14-26-12-9-21-19(26)20(29-16)6-10-25(11-7-20)17(27)15-5-8-22-23-13-15/h5,8-9,12-13,16H,3-4,6-7,10-11,14H2,1-2H3/t16-/m1/s1.
What are the key properties of (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide?
(6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide has a molecular weight of 398.47 g/mol, XLogP of 1.07, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-N,N-diethyl-1'-(pyridazine-4-carbonyl)spiro[5,6-dihydroimidazo[2,1-c][1,4]oxazine-8,4'-piperidine]-6-carboxamide is sourced from PubChem (CID 97360918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).