5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide

C10H13ClN4O2 — CID 107249224

IUPAC5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
SMILESCC(NC(=O)c1cnc(Cl)cn1)C(=O)N(C)C
InChIInChI=1S/C10H13ClN4O2/c1-6(10(17)15(2)3)14-9(16)7-4-13-8(11)5-12-7/h4-6H,1-3H3,(H,14,16)
InChIKeyFFNHCEAWAMYKSX-UHFFFAOYSA-N
MW256.69 g/mol
LogP0.34
Rot. Bonds3

About 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide

5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide (PubChem CID 107249224) has the molecular formula C10H13ClN4O2 and a molecular weight of 256.69 g/mol. Its IUPAC name is 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
PubChem CID107249224
Molecular FormulaC10H13ClN4O2
Molecular Weight256.69 g/mol
Exact Mass256.07
IUPAC Name5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
SMILESCC(NC(=O)c1cnc(Cl)cn1)C(=O)N(C)C
InChIInChI=1S/C10H13ClN4O2/c1-6(10(17)15(2)3)14-9(16)7-4-13-8(11)5-12-7/h4-6H,1-3H3,(H,14,16)
InChIKeyFFNHCEAWAMYKSX-UHFFFAOYSA-N
XLogP0.34
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.69
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-[1-(diethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 107371850
2-[(5-chloropyrazine-2-carbonyl)amino]propanoic acid
CID 107371387
5-chloro-N-[4-(dimethylamino)butan-2-yl]pyrazine-2-carboxamide
CID 107257919
5-chloro-N-[(2S)-1-hydroxypropan-2-yl]pyrazine-2-carboxamide
CID 107258262
(2S)-2-[(5-chloropyrazine-2-carbonyl)amino]-3-methylbutanoic acid
CID 107371470
5-chloro-N-(1,1-dimethoxypropan-2-yl)pyrazine-2-carboxamide
CID 107372068
5-chloro-N-[2-(dimethylamino)propyl]pyrazine-2-carboxamide
CID 107246707
N-[1-(dimethylamino)-1-oxopropan-2-yl]-2H-triazole-4-carboxamide
CID 112733461
5-chloro-N-[1-(4-methylphenyl)ethyl]pyrazine-2-carboxamide
CID 107244492
5-[[1-(dimethylamino)-1-oxopropan-2-yl]carbamoyl]pyridine-2-carboxylic acid
CID 61030950
5-chloro-N-(4-methylsulfanylbutan-2-yl)pyrazine-2-carboxamide
CID 107257777
5-(3-aminoprop-1-ynyl)-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyridine-2-carboxamide
CID 62954188

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
The IUPAC name of 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide (CID 107249224) is 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
The canonical SMILES for 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide is CC(NC(=O)c1cnc(Cl)cn1)C(=O)N(C)C.
What is the InChIKey of 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
The InChIKey is FFNHCEAWAMYKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN4O2/c1-6(10(17)15(2)3)14-9(16)7-4-13-8(11)5-12-7/h4-6H,1-3H3,(H,14,16).
What are the key properties of 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide?
5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide has a molecular weight of 256.69 g/mol, XLogP of 0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(dimethylamino)-1-oxopropan-2-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 107249224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).