5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide

C19H21FN8O — CID 167273203

IUPAC5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3cnc(N4CC(CNC5CC5)C4)cn3)nc(F)c2n1
InChIInChI=1S/C19H21FN8O/c1-11-7-28-10-15(25-17(20)18(28)24-11)26-19(29)14-5-23-16(6-22-14)27-8-12(9-27)4-21-13-2-3-13/h5-7,10,12-13,21H,2-4,8-9H2,1H3,(H,26,29)
InChIKeyLALKBJLYHBFAAP-UHFFFAOYSA-N
MW396.43 g/mol
LogP1.41
Rot. Bonds6

About 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide

5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide (PubChem CID 167273203) has the molecular formula C19H21FN8O and a molecular weight of 396.43 g/mol. Its IUPAC name is 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
PubChem CID167273203
Molecular FormulaC19H21FN8O
Molecular Weight396.43 g/mol
Exact Mass396.18
IUPAC Name5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
SMILESCc1cn2cc(NC(=O)c3cnc(N4CC(CNC5CC5)C4)cn3)nc(F)c2n1
InChIInChI=1S/C19H21FN8O/c1-11-7-28-10-15(25-17(20)18(28)24-11)26-19(29)14-5-23-16(6-22-14)27-8-12(9-27)4-21-13-2-3-13/h5-7,10,12-13,21H,2-4,8-9H2,1H3,(H,26,29)
InChIKeyLALKBJLYHBFAAP-UHFFFAOYSA-N
XLogP1.41
TPSA100.34 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.43
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

5-[(3S)-3-(cyclopropylmethylamino)pyrrolidin-1-yl]-N-(8-methoxy-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507583
5-[3-[(cyclopropylamino)methyl]-3-fluoropyrrolidin-1-yl]-N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide
CID 166507780
5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(7-fluoro-2-methylindazol-5-yl)pyrazine-2-carboxamide
CID 166848046
N-(2,8-dimethylimidazo[1,2-a]pyrazin-6-yl)-5-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyrazine-2-carboxamide
CID 166507653
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[3-[[(3R)-3-fluoropyrrolidin-1-yl]methyl]azetidin-1-yl]pyrazine-2-carboxamide
CID 166507514
5-(2-cyclopropyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carboxamide
CID 166507512
5-[(3R)-3-(ethylamino)pyrrolidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrazine-2-carboxamide
CID 166507752
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[3-[(3-methoxyazetidin-1-yl)methyl]azetidin-1-yl]pyrazine-2-carboxamide
CID 166507696
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[(1R,5S)-6-pyrrolidin-1-yl-3-azabicyclo[3.1.0]hexan-3-yl]pyrazine-2-carboxamide
CID 168758548
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 166848042
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-[3-[(2S)-piperidin-2-yl]azetidin-1-yl]pyrazine-2-carboxamide
CID 167528526
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-5-(2-methyl-2,7-diazaspiro[3.5]nonan-7-yl)pyrazine-2-carboxamide
CID 166508029

Frequently Asked Questions

What is the IUPAC name of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
The IUPAC name of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide (CID 167273203) is 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
The canonical SMILES for 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide is Cc1cn2cc(NC(=O)c3cnc(N4CC(CNC5CC5)C4)cn3)nc(F)c2n1.
What is the InChIKey of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
The InChIKey is LALKBJLYHBFAAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN8O/c1-11-7-28-10-15(25-17(20)18(28)24-11)26-19(29)14-5-23-16(6-22-14)27-8-12(9-27)4-21-13-2-3-13/h5-7,10,12-13,21H,2-4,8-9H2,1H3,(H,26,29).
What are the key properties of 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide?
5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide has a molecular weight of 396.43 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-[(cyclopropylamino)methyl]azetidin-1-yl]-N-(8-fluoro-2-methylimidazo[1,2-a]pyrazin-6-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 167273203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).