N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide

C13H22N4O2 — CID 107376148

IUPACN-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)N(CC)CC(C)(C)O)cn1
InChIInChI=1S/C13H22N4O2/c1-5-14-11-8-15-10(7-16-11)12(18)17(6-2)9-13(3,4)19/h7-8,19H,5-6,9H2,1-4H3,(H,14,16)
InChIKeyOFMOXXPVQMKNCZ-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.14
Rot. Bonds6

About N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide

N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide (PubChem CID 107376148) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide
PubChem CID107376148
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide
SMILESCCNc1cnc(C(=O)N(CC)CC(C)(C)O)cn1
InChIInChI=1S/C13H22N4O2/c1-5-14-11-8-15-10(7-16-11)12(18)17(6-2)9-13(3,4)19/h7-8,19H,5-6,9H2,1-4H3,(H,14,16)
InChIKeyOFMOXXPVQMKNCZ-UHFFFAOYSA-N
XLogP1.14
TPSA78.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-5-(ethylamino)-N-(oxolan-2-ylmethyl)pyrazine-2-carboxamide
CID 107374808
N-butyl-N-ethyl-5-(propylamino)pyrazine-2-carboxamide
CID 107374046
N,N-diethyl-5-[(4-methylphenyl)methylamino]pyrazine-2-carboxamide
CID 109280656
N-ethyl-5-hydrazinyl-N-propylpyrazine-2-carboxamide
CID 107378064
N-(2,2-dimethylbutyl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107377291
N-propyl-5-(propylamino)-N-(2,2,2-trifluoroethyl)pyrazine-2-carboxamide
CID 107374760
5-(aminomethyl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
CID 79384484
5-(ethylamino)-N-[(2-fluorophenyl)methyl]-N-methylpyrazine-2-carboxamide
CID 107375107
5-(ethylamino)-N-(4-ethylphenyl)-N-methylpyrazine-2-carboxamide
CID 107375022
N-benzyl-5-(butylamino)-N-ethylpyrazine-2-carboxamide
CID 109272566
N-ethyl-N-(2-hydroxy-2-methylpropyl)-1-methylimidazole-4-carboxamide
CID 103803952
5-(ethylamino)-N-methyl-N-(4-methylsulfanylbutan-2-yl)pyrazine-2-carboxamide
CID 107377004

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide?
The IUPAC name of N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide (CID 107376148) is N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide?
The canonical SMILES for N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide is CCNc1cnc(C(=O)N(CC)CC(C)(C)O)cn1.
What is the InChIKey of N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide?
The InChIKey is OFMOXXPVQMKNCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-5-14-11-8-15-10(7-16-11)12(18)17(6-2)9-13(3,4)19/h7-8,19H,5-6,9H2,1-4H3,(H,14,16).
What are the key properties of N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide?
N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(ethylamino)-N-(2-hydroxy-2-methylpropyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107376148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).