N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide

C14H24N4O2 — CID 107377139

IUPACN-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)NCC(C)(C)OCC)cn1
InChIInChI=1S/C14H24N4O2/c1-5-7-15-12-9-16-11(8-17-12)13(19)18-10-14(3,4)20-6-2/h8-9H,5-7,10H2,1-4H3,(H,15,17)(H,18,19)
InChIKeyIWFHFEVRSRMNGF-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.84
Rot. Bonds8

About N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide

N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide (PubChem CID 107377139) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide
PubChem CID107377139
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC NameN-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide
SMILESCCCNc1cnc(C(=O)NCC(C)(C)OCC)cn1
InChIInChI=1S/C14H24N4O2/c1-5-7-15-12-9-16-11(8-17-12)13(19)18-10-14(3,4)20-6-2/h8-9H,5-7,10H2,1-4H3,(H,15,17)(H,18,19)
InChIKeyIWFHFEVRSRMNGF-UHFFFAOYSA-N
XLogP1.84
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107376810
N-(3,3-dimethylbutyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107376964
N-(2-methoxyethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109270966
5-(propylamino)-N-(2,3,3-trimethylbutyl)pyrazine-2-carboxamide
CID 107376665
N-(2-methylbutan-2-yl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374127
N-[(4-methylcyclohexyl)methyl]-5-(propylamino)pyrazine-2-carboxamide
CID 107375618
N-(4-methylpentyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107375562
N-(2-cyclohexylethyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107374667
N-(3-cyclopentylpropyl)-5-(propylamino)pyrazine-2-carboxamide
CID 106015585
N-(2,2-dimethylbutyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107377291
5-(propylamino)-N-(3-sulfamoylpropyl)pyrazine-2-carboxamide
CID 107374837
N-[2-(4-methoxyphenyl)ethyl]-5-(propylamino)pyrazine-2-carboxamide
CID 109271001

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide (CID 107377139) is N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide is CCCNc1cnc(C(=O)NCC(C)(C)OCC)cn1.
What is the InChIKey of N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide?
The InChIKey is IWFHFEVRSRMNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-5-7-15-12-9-16-11(8-17-12)13(19)18-10-14(3,4)20-6-2/h8-9H,5-7,10H2,1-4H3,(H,15,17)(H,18,19).
What are the key properties of N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide?
N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 1.84, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-2-methylpropyl)-5-(propylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 107377139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).