5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole

C17H24N4OS — CID 97421978

IUPAC5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole
SMILESCc1ncsc1CN1CCn2c(COCC3CC3)cnc2[C@H]1C
InChIInChI=1S/C17H24N4OS/c1-12-16(23-11-19-12)8-20-5-6-21-15(7-18-17(21)13(20)2)10-22-9-14-3-4-14/h7,11,13-14H,3-6,8-10H2,1-2H3/t13-/m1/s1
InChIKeyBRCSWIQRCVBESM-CYBMUJFWSA-N
MW332.47 g/mol
LogP3.15
Rot. Bonds6

About 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole

5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole (PubChem CID 97421978) has the molecular formula C17H24N4OS and a molecular weight of 332.47 g/mol. Its IUPAC name is 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole
PubChem CID97421978
Molecular FormulaC17H24N4OS
Molecular Weight332.47 g/mol
Exact Mass332.17
IUPAC Name5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole
SMILESCc1ncsc1CN1CCn2c(COCC3CC3)cnc2[C@H]1C
InChIInChI=1S/C17H24N4OS/c1-12-16(23-11-19-12)8-20-5-6-21-15(7-18-17(21)13(20)2)10-22-9-14-3-4-14/h7,11,13-14H,3-6,8-10H2,1-2H3/t13-/m1/s1
InChIKeyBRCSWIQRCVBESM-CYBMUJFWSA-N
XLogP3.15
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[(8S)-3-(ethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-1,3-thiazole
CID 97421882
(8R)-3-(cyclopropylmethoxymethyl)-7-cyclopropylsulfonyl-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97421987
3-(ethoxymethyl)-8-methyl-7-(thiophen-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 118743048
[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-(5-methylthiophen-2-yl)methanone
CID 97421996
(8R)-3-(ethoxymethyl)-8-methyl-7-[(1-methylpyrazol-4-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97421879
[3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyridazin-4-ylmethanone
CID 118741079
(3R,3aS,7aR)-3-(cyclopropylmethoxy)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrole
CID 97366181
N,N-dimethyl-2-[[(8S)-8-methyl-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methoxy]acetamide
CID 97421949
(8R)-8-methyl-3-(pyridin-2-ylmethoxymethyl)-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 97474204
9-(cyclopropylmethoxy)-5-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-oxa-5-azabicyclo[4.2.1]nonane
CID 131663375
5-[[1-(cyclopropylmethyl)-7-(methoxymethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]methyl]-4-methyl-1,3-thiazole
CID 134072108
(3S)-3-(cyclopropylmethoxymethyl)-8-[(4-methyl-1,3-thiazol-5-yl)methyl]-2-oxa-8-azaspiro[4.5]decane
CID 97476713

Frequently Asked Questions

What is the IUPAC name of 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole?
The IUPAC name of 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole (CID 97421978) is 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole.
What is the SMILES notation for 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole?
The canonical SMILES for 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole is Cc1ncsc1CN1CCn2c(COCC3CC3)cnc2[C@H]1C.
What is the InChIKey of 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole?
The InChIKey is BRCSWIQRCVBESM-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H24N4OS/c1-12-16(23-11-19-12)8-20-5-6-21-15(7-18-17(21)13(20)2)10-22-9-14-3-4-14/h7,11,13-14H,3-6,8-10H2,1-2H3/t13-/m1/s1.
What are the key properties of 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole?
5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole has a molecular weight of 332.47 g/mol, XLogP of 3.15, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(8R)-3-(cyclopropylmethoxymethyl)-8-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methyl]-4-methyl-1,3-thiazole is sourced from PubChem (CID 97421978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).