(5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide

C15H21N5O3 — CID 124795951

IUPAC(5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
SMILESCOCCNC(=O)[C@H]1CN(Cc2cc(C)on2)Cc2cncn21
InChIInChI=1S/C15H21N5O3/c1-11-5-12(18-23-11)7-19-8-13-6-16-10-20(13)14(9-19)15(21)17-3-4-22-2/h5-6,10,14H,3-4,7-9H2,1-2H3,(H,17,21)/t14-/m1/s1
InChIKeyDBRHEUTXYNMWBV-CQSZACIVSA-N
MW319.37 g/mol
LogP0.50
Rot. Bonds6

About (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide

(5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide (PubChem CID 124795951) has the molecular formula C15H21N5O3 and a molecular weight of 319.37 g/mol. Its IUPAC name is (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide.

Molecular Properties

Compound Name(5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
PubChem CID124795951
Molecular FormulaC15H21N5O3
Molecular Weight319.37 g/mol
Exact Mass319.16
IUPAC Name(5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
SMILESCOCCNC(=O)[C@H]1CN(Cc2cc(C)on2)Cc2cncn21
InChIInChI=1S/C15H21N5O3/c1-11-5-12(18-23-11)7-19-8-13-6-16-10-20(13)14(9-19)15(21)17-3-4-22-2/h5-6,10,14H,3-4,7-9H2,1-2H3,(H,17,21)/t14-/m1/s1
InChIKeyDBRHEUTXYNMWBV-CQSZACIVSA-N
XLogP0.50
TPSA85.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.37
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(5R)-N-cyclobutyl-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 124795796
7-[2-(4-chlorophenoxy)ethyl]-N-(2-methoxyethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 133142253
7-(cyclobutanecarbonyl)-N-(2-methoxyethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 131694370
(2S,3aR,7aR)-N-(2-methoxyethyl)-6-[(5-methyl-1,2-oxazol-3-yl)methyl]-3,3a,4,5,7,7a-hexahydro-2H-furo[2,3-c]pyridine-2-carboxamide
CID 124798124
5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid
CID 155826204
7-[(2-methoxy-3-pyridinyl)methyl]-N-propan-2-yl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide
CID 131638794
N-(2-methoxyethyl)-8-methyl-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 131662656
5-(1H-indol-4-ylmethyl)-N-(2-methoxyethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 133141807
N-(cyclopropylmethyl)-2-[5-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131641559
N-(2-methoxyethyl)-5-(pyridin-4-ylmethyl)-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-7-carboxamide
CID 118747205
(2S)-1-(2-methoxyacetyl)-4-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-2-carboxamide
CID 124679947
N-(3-methoxypropyl)-1-(5-methyl-1,2-oxazole-3-carbonyl)azetidine-3-carboxamide
CID 71785242

Frequently Asked Questions

What is the IUPAC name of (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
The IUPAC name of (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide (CID 124795951) is (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide.
What is the SMILES notation for (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
The canonical SMILES for (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide is COCCNC(=O)[C@H]1CN(Cc2cc(C)on2)Cc2cncn21.
What is the InChIKey of (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
The InChIKey is DBRHEUTXYNMWBV-CQSZACIVSA-N. The full InChI is InChI=1S/C15H21N5O3/c1-11-5-12(18-23-11)7-19-8-13-6-16-10-20(13)14(9-19)15(21)17-3-4-22-2/h5-6,10,14H,3-4,7-9H2,1-2H3,(H,17,21)/t14-/m1/s1.
What are the key properties of (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide?
(5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide has a molecular weight of 319.37 g/mol, XLogP of 0.50, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-N-(2-methoxyethyl)-7-[(5-methyl-1,2-oxazol-3-yl)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-5-carboxamide is sourced from PubChem (CID 124795951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).