2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid

C10H15N5O3 — CID 67154587

IUPAC2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid
SMILESNC(CNC(=O)N1CCn2ccnc2C1)C(=O)O
InChIInChI=1S/C10H15N5O3/c11-7(9(16)17)5-13-10(18)15-4-3-14-2-1-12-8(14)6-15/h1-2,7H,3-6,11H2,(H,13,18)(H,16,17)
InChIKeyHREFOEQYHGCOQZ-UHFFFAOYSA-N
MW253.26 g/mol
LogP-1.18
Rot. Bonds3

About 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid

2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid (PubChem CID 67154587) has the molecular formula C10H15N5O3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid.

Molecular Properties

Compound Name2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid
PubChem CID67154587
Molecular FormulaC10H15N5O3
Molecular Weight253.26 g/mol
Exact Mass253.12
IUPAC Name2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid
SMILESNC(CNC(=O)N1CCn2ccnc2C1)C(=O)O
InChIInChI=1S/C10H15N5O3/c11-7(9(16)17)5-13-10(18)15-4-3-14-2-1-12-8(14)6-15/h1-2,7H,3-6,11H2,(H,13,18)(H,16,17)
InChIKeyHREFOEQYHGCOQZ-UHFFFAOYSA-N
XLogP-1.18
TPSA113.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-1.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-amino-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-5-oxopentanoic acid
CID 67356179
(2S)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)-3-hydroxypropanoic acid
CID 63026894
(2S)-4-amino-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)-4-oxobutanoic acid
CID 63716634
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid
CID 55143467
(2S)-2-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butan-1-one;dihydrochloride
CID 119874214
(2S,3S)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)-3-methylpentanoic acid
CID 63026749
(2S)-2-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)pentan-1-one
CID 94939389
(2R)-2-amino-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4-methylpentan-1-one
CID 104903447
N-cyclopropyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
CID 115642001
2-bromo-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanone
CID 63680123
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)-4-methylsulfanylbutanoic acid
CID 63026560
4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid
CID 63026887

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid?
The IUPAC name of 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid (CID 67154587) is 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid.
What is the SMILES notation for 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid?
The canonical SMILES for 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid is NC(CNC(=O)N1CCn2ccnc2C1)C(=O)O.
What is the InChIKey of 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid?
The InChIKey is HREFOEQYHGCOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3/c11-7(9(16)17)5-13-10(18)15-4-3-14-2-1-12-8(14)6-15/h1-2,7H,3-6,11H2,(H,13,18)(H,16,17).
What are the key properties of 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid?
2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid has a molecular weight of 253.26 g/mol, XLogP of -1.18, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid is sourced from PubChem (CID 67154587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).