N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide

C21H22N6O4 — CID 154334689

IUPACN-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide
SMILESC[C@H](CO)NC(=O)c1ccc2ncc(-c3cc4c(N5CCOCC5)ccnc4o3)n2n1
InChIInChI=1S/C21H22N6O4/c1-13(12-28)24-20(29)15-2-3-19-23-11-17(27(19)25-15)18-10-14-16(4-5-22-21(14)31-18)26-6-8-30-9-7-26/h2-5,10-11,13,28H,6-9,12H2,1H3,(H,24,29)/t13-/m1/s1
InChIKeyMVVHDHBRMJVPHQ-CYBMUJFWSA-N
MW422.45 g/mol
LogP1.48
Rot. Bonds5

About N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide

N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide (PubChem CID 154334689) has the molecular formula C21H22N6O4 and a molecular weight of 422.45 g/mol. Its IUPAC name is N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide
PubChem CID154334689
Molecular FormulaC21H22N6O4
Molecular Weight422.45 g/mol
Exact Mass422.17
IUPAC NameN-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide
SMILESC[C@H](CO)NC(=O)c1ccc2ncc(-c3cc4c(N5CCOCC5)ccnc4o3)n2n1
InChIInChI=1S/C21H22N6O4/c1-13(12-28)24-20(29)15-2-3-19-23-11-17(27(19)25-15)18-10-14-16(4-5-22-21(14)31-18)26-6-8-30-9-7-26/h2-5,10-11,13,28H,6-9,12H2,1H3,(H,24,29)/t13-/m1/s1
InChIKeyMVVHDHBRMJVPHQ-CYBMUJFWSA-N
XLogP1.48
TPSA118.02 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.45
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Analyze N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide with MolForge

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Related Compounds

N-benzyl-3-(4-morpholin-4-ylfuro[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide
CID 118227019
4-methoxy-1-[3-(4-morpholin-4-ylfuro[3,2-c]pyridin-2-yl)imidazo[1,2-b]pyridazin-6-yl]butan-1-one
CID 152911460
N-butan-2-yl-5-morpholin-4-ylpyridine-2-carboxamide
CID 109181400
N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide
CID 109202858
N-butan-2-yl-7-(1,5-dimethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19466570
N-[(2R)-1-hydroxypropan-2-yl]-5-piperazin-1-ylpyridine-2-carboxamide
CID 166082435
6-morpholin-4-yl-N-propan-2-ylpyridazine-3-carboxamide
CID 109109608
N-butan-2-yl-5-morpholin-4-ylpyridine-3-carboxamide
CID 109225123
7-(1,5-dimethylpyrazol-4-yl)-N-(2-morpholin-4-ylethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 19468313
2-(2-morpholin-4-yl-4-pyridinyl)-N-[(2R)-4-phenylbutan-2-yl]-1,3-thiazole-4-carboxamide
CID 95089020
N-butan-2-yl-4-morpholin-4-ylquinazoline-6-carboxamide
CID 71842372
N-[(2R)-1-hydroxypropan-2-yl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 79027672

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide?
The IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide (CID 154334689) is N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide.
What is the SMILES notation for N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide?
The canonical SMILES for N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide is C[C@H](CO)NC(=O)c1ccc2ncc(-c3cc4c(N5CCOCC5)ccnc4o3)n2n1.
What is the InChIKey of N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide?
The InChIKey is MVVHDHBRMJVPHQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C21H22N6O4/c1-13(12-28)24-20(29)15-2-3-19-23-11-17(27(19)25-15)18-10-14-16(4-5-22-21(14)31-18)26-6-8-30-9-7-26/h2-5,10-11,13,28H,6-9,12H2,1H3,(H,24,29)/t13-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide?
N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide has a molecular weight of 422.45 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxypropan-2-yl]-3-(4-morpholin-4-ylfuro[2,3-b]pyridin-2-yl)imidazo[1,2-b]pyridazine-6-carboxamide is sourced from PubChem (CID 154334689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).