(3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone

C17H21N5O2 — CID 131697407

IUPAC(3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone
SMILESCOc1cnccc1C(=O)N1CCC2(C1)Cn1ccnc1CN2C
InChIInChI=1S/C17H21N5O2/c1-20-10-15-19-6-8-21(15)11-17(20)4-7-22(12-17)16(23)13-3-5-18-9-14(13)24-2/h3,5-6,8-9H,4,7,10-12H2,1-2H3
InChIKeyNQARSJXDWOJSNE-UHFFFAOYSA-N
MW327.39 g/mol
LogP1.02
Rot. Bonds2

About (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone

(3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone (PubChem CID 131697407) has the molecular formula C17H21N5O2 and a molecular weight of 327.39 g/mol. Its IUPAC name is (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone.

Molecular Properties

Compound Name(3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone
PubChem CID131697407
Molecular FormulaC17H21N5O2
Molecular Weight327.39 g/mol
Exact Mass327.17
IUPAC Name(3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone
SMILESCOc1cnccc1C(=O)N1CCC2(C1)Cn1ccnc1CN2C
InChIInChI=1S/C17H21N5O2/c1-20-10-15-19-6-8-21(15)11-17(20)4-7-22(12-17)16(23)13-3-5-18-9-14(13)24-2/h3,5-6,8-9H,4,7,10-12H2,1-2H3
InChIKeyNQARSJXDWOJSNE-UHFFFAOYSA-N
XLogP1.02
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-1-(3-methoxypyridine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 107323207
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(2-methoxyphenyl)methanone
CID 110712610
(3-methoxy-4-pyridinyl)-morpholin-4-ylmethanone
CID 105063802
4-(3-methoxypyridine-4-carbonyl)piperazin-2-one
CID 105063980
(3,5-dimethylpiperazin-1-yl)-(3-methoxy-4-pyridinyl)methanone
CID 105064090
(3-methoxy-1-oxa-8-azaspiro[4.5]decan-8-yl)-(3-methoxy-4-pyridinyl)methanone
CID 131689296
[4-(chloromethyl)piperidin-1-yl]-(3-methoxy-4-pyridinyl)methanone
CID 105064486
(7,11-dimethyl-3,7,11-triazaspiro[5.6]dodecan-3-yl)-(3-hydroxy-4-pyridinyl)methanone
CID 77090878
(3-methoxy-4-pyridinyl)-(5-methylsulfonylspiro[6H-pyrrolo[2,3-b]pyrazine-7,3'-azetidine]-1'-yl)methanone
CID 131696996
[4a-(methoxymethyl)-3,4,5,7,8,8a-hexahydro-2H-pyrano[3,2-c]pyridin-6-yl]-(3-methoxy-4-pyridinyl)methanone
CID 131691435
(5-amino-1,3-dihydroisoindol-2-yl)-(3-methoxy-4-pyridinyl)methanone
CID 105063024
[4-(ethylamino)piperidin-1-yl]-(3-methoxy-4-pyridinyl)methanone
CID 105062869

Frequently Asked Questions

What is the IUPAC name of (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone?
The IUPAC name of (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone (CID 131697407) is (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone.
What is the SMILES notation for (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone?
The canonical SMILES for (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone is COc1cnccc1C(=O)N1CCC2(C1)Cn1ccnc1CN2C.
What is the InChIKey of (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone?
The InChIKey is NQARSJXDWOJSNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O2/c1-20-10-15-19-6-8-21(15)11-17(20)4-7-22(12-17)16(23)13-3-5-18-9-14(13)24-2/h3,5-6,8-9H,4,7,10-12H2,1-2H3.
What are the key properties of (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone?
(3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone has a molecular weight of 327.39 g/mol, XLogP of 1.02, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxy-4-pyridinyl)-(7-methylspiro[5,8-dihydroimidazo[1,2-a]pyrazine-6,3'-pyrrolidine]-1'-yl)methanone is sourced from PubChem (CID 131697407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).