N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide

C12H18N4O2 — CID 51088431

IUPACN-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide
SMILESCCN(CC)C(=O)CCNC(=O)c1cnccn1
InChIInChI=1S/C12H18N4O2/c1-3-16(4-2)11(17)5-6-15-12(18)10-9-13-7-8-14-10/h7-9H,3-6H2,1-2H3,(H,15,18)
InChIKeyGPSQIDPSARNBQS-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.46
Rot. Bonds6

About N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide

N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide (PubChem CID 51088431) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide
PubChem CID51088431
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide
SMILESCCN(CC)C(=O)CCNC(=O)c1cnccn1
InChIInChI=1S/C12H18N4O2/c1-3-16(4-2)11(17)5-6-15-12(18)10-9-13-7-8-14-10/h7-9H,3-6H2,1-2H3,(H,15,18)
InChIKeyGPSQIDPSARNBQS-UHFFFAOYSA-N
XLogP0.46
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-hydroxyethyl)pyrazine-2-carboxamide
CID 14230272
N-[3-(diethylamino)-3-oxopropyl]-N-propylpyrazine-2-carboxamide
CID 3621846
N-[10-(pyrazine-2-carbonylamino)decyl]pyrazine-2-carboxamide
CID 71517100
N-butyl-N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide
CID 5059677
N-[3-(diethylamino)-3-oxopropyl]-N-(2-methoxyethyl)pyrazine-2-carboxamide
CID 42783341
N-cyclopropyl-N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide
CID 3402919
methyl N-[2-(pyrazine-2-carbonylamino)ethyl]carbamate
CID 108574667
N-(2-methylprop-2-enyl)pyrazine-2-carboxamide
CID 114618266
N-(5-hydroxypentyl)pyrazine-2-carboxamide
CID 108796814
N',N'-diethyl-N-pyrazin-2-ylbutanediamide
CID 75508705
methyl 3-[ethyl(pyrazine-2-carbonyl)amino]propanoate
CID 54899038
N-(2,2-diethoxyethyl)pyrazine-2-carboxamide
CID 103602082

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide?
The IUPAC name of N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide (CID 51088431) is N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide is CCN(CC)C(=O)CCNC(=O)c1cnccn1.
What is the InChIKey of N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide?
The InChIKey is GPSQIDPSARNBQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-3-16(4-2)11(17)5-6-15-12(18)10-9-13-7-8-14-10/h7-9H,3-6H2,1-2H3,(H,15,18).
What are the key properties of N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide?
N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)-3-oxopropyl]pyrazine-2-carboxamide is sourced from PubChem (CID 51088431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).