N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide

C10H10N6O2 — CID 71703882

IUPACN-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide
SMILESO=C(CNC(=O)c1cnccn1)Nc1ncc[nH]1
InChIInChI=1S/C10H10N6O2/c17-8(16-10-13-3-4-14-10)6-15-9(18)7-5-11-1-2-12-7/h1-5H,6H2,(H,15,18)(H2,13,14,16,17)
InChIKeyVDGJICVPEFMKSM-UHFFFAOYSA-N
MW246.23 g/mol
LogP-0.43
Rot. Bonds4

About N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide

N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide (PubChem CID 71703882) has the molecular formula C10H10N6O2 and a molecular weight of 246.23 g/mol. Its IUPAC name is N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide
PubChem CID71703882
Molecular FormulaC10H10N6O2
Molecular Weight246.23 g/mol
Exact Mass246.09
IUPAC NameN-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide
SMILESO=C(CNC(=O)c1cnccn1)Nc1ncc[nH]1
InChIInChI=1S/C10H10N6O2/c17-8(16-10-13-3-4-14-10)6-15-9(18)7-5-11-1-2-12-7/h1-5H,6H2,(H,15,18)(H2,13,14,16,17)
InChIKeyVDGJICVPEFMKSM-UHFFFAOYSA-N
XLogP-0.43
TPSA112.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 5-0.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide (CID 71703882) is N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide is O=C(CNC(=O)c1cnccn1)Nc1ncc[nH]1.
What is the InChIKey of N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide?
The InChIKey is VDGJICVPEFMKSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6O2/c17-8(16-10-13-3-4-14-10)6-15-9(18)7-5-11-1-2-12-7/h1-5H,6H2,(H,15,18)(H2,13,14,16,17).
What are the key properties of N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide?
N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide has a molecular weight of 246.23 g/mol, XLogP of -0.43, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-imidazol-2-ylamino)-2-oxoethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 71703882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).