4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid

C14H20N4O3 — CID 63026887

IUPAC4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCC(NC(=O)N2CCn3ccnc3C2)CC1
InChIInChI=1S/C14H20N4O3/c19-13(20)10-1-3-11(4-2-10)16-14(21)18-8-7-17-6-5-15-12(17)9-18/h5-6,10-11H,1-4,7-9H2,(H,16,21)(H,19,20)
InChIKeyONTNVOYDJILHSP-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.05
Rot. Bonds2

About 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid

4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid (PubChem CID 63026887) has the molecular formula C14H20N4O3 and a molecular weight of 292.34 g/mol. Its IUPAC name is 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid
PubChem CID63026887
Molecular FormulaC14H20N4O3
Molecular Weight292.34 g/mol
Exact Mass292.15
IUPAC Name4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid
SMILESO=C(O)C1CCC(NC(=O)N2CCn3ccnc3C2)CC1
InChIInChI=1S/C14H20N4O3/c19-13(20)10-1-3-11(4-2-10)16-14(21)18-8-7-17-6-5-15-12(17)9-18/h5-6,10-11H,1-4,7-9H2,(H,16,21)(H,19,20)
InChIKeyONTNVOYDJILHSP-UHFFFAOYSA-N
XLogP1.05
TPSA87.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
CID 115642001
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid
CID 55143467
1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonyl)piperidine-2-carboxylic acid
CID 63026728
2-(cyclopentylamino)-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanone
CID 63025397
(2S)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)-3-hydroxypropanoic acid
CID 63026894
methyl 6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate
CID 110712648
2-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)propanoic acid
CID 67154587
3-phenyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxamide
CID 127953120
3-[cyclopropyl(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonyl)amino]propanoic acid
CID 63026888
4-[(4-cyclopropylpiperazine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 61443231
(2S)-4-amino-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)-4-oxobutanoic acid
CID 63716634
N,N-dimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide
CID 115627322

Frequently Asked Questions

What is the IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid?
The IUPAC name of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid (CID 63026887) is 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid?
The canonical SMILES for 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid is O=C(O)C1CCC(NC(=O)N2CCn3ccnc3C2)CC1.
What is the InChIKey of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid?
The InChIKey is ONTNVOYDJILHSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O3/c19-13(20)10-1-3-11(4-2-10)16-14(21)18-8-7-17-6-5-15-12(17)9-18/h5-6,10-11H,1-4,7-9H2,(H,16,21)(H,19,20).
What are the key properties of 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid?
4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid has a molecular weight of 292.34 g/mol, XLogP of 1.05, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonylamino)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 63026887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).