N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide

C16H20N4O2 — CID 157399897

IUPACN,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide
SMILESCC(C)Cc1cccn(-c2cnc(C(=O)N(C)C)cn2)c1=O
InChIInChI=1S/C16H20N4O2/c1-11(2)8-12-6-5-7-20(15(12)21)14-10-17-13(9-18-14)16(22)19(3)4/h5-7,9-11H,8H2,1-4H3
InChIKeyIJZCFZGHUJXAOB-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.53
Rot. Bonds4

About N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide

N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide (PubChem CID 157399897) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide
PubChem CID157399897
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC NameN,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide
SMILESCC(C)Cc1cccn(-c2cnc(C(=O)N(C)C)cn2)c1=O
InChIInChI=1S/C16H20N4O2/c1-11(2)8-12-6-5-7-20(15(12)21)14-10-17-13(9-18-14)16(22)19(3)4/h5-7,9-11H,8H2,1-4H3
InChIKeyIJZCFZGHUJXAOB-UHFFFAOYSA-N
XLogP1.53
TPSA68.09 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide?
The IUPAC name of N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide (CID 157399897) is N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide is CC(C)Cc1cccn(-c2cnc(C(=O)N(C)C)cn2)c1=O.
What is the InChIKey of N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide?
The InChIKey is IJZCFZGHUJXAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-11(2)8-12-6-5-7-20(15(12)21)14-10-17-13(9-18-14)16(22)19(3)4/h5-7,9-11H,8H2,1-4H3.
What are the key properties of N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide?
N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.53, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[3-(2-methylpropyl)-2-oxo-1-pyridinyl]pyrazine-2-carboxamide is sourced from PubChem (CID 157399897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).