5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide

C14H23N5O — CID 109271173

IUPAC5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide
SMILESCCN1CCN(c2cnc(C(=O)NC(C)C)cn2)CC1
InChIInChI=1S/C14H23N5O/c1-4-18-5-7-19(8-6-18)13-10-15-12(9-16-13)14(20)17-11(2)3/h9-11H,4-8H2,1-3H3,(H,17,20)
InChIKeyQAKRQIFXEJUCIS-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.76
Rot. Bonds4

About 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide

5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide (PubChem CID 109271173) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide
PubChem CID109271173
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide
SMILESCCN1CCN(c2cnc(C(=O)NC(C)C)cn2)CC1
InChIInChI=1S/C14H23N5O/c1-4-18-5-7-19(8-6-18)13-10-15-12(9-16-13)14(20)17-11(2)3/h9-11H,4-8H2,1-3H3,(H,17,20)
InChIKeyQAKRQIFXEJUCIS-UHFFFAOYSA-N
XLogP0.76
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-(4-ethylpiperazin-1-yl)pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 109273513
6-(4-ethylpiperazin-1-yl)-2-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360588
N-butan-2-yl-5-(4-pyrimidin-2-ylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109273181
5-(4-ethylpiperazin-1-yl)-N-[(4-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109278578
N-propan-2-yl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyrazine-2-carboxamide
CID 69354025
N-[2-(cyclohexen-1-yl)ethyl]-5-(4-ethylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109275377
5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109278676
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-ethylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109278606
5-(4-ethylpiperazin-1-yl)-N-[2-(3-methoxyphenyl)ethyl]pyrazine-2-carboxamide
CID 109278597
5-(azepan-1-yl)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280802
N-propan-2-yl-6-(4-propylpiperazin-1-yl)pyridine-3-carboxamide
CID 168923141
N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274517

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide?
The IUPAC name of 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide (CID 109271173) is 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide?
The canonical SMILES for 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide is CCN1CCN(c2cnc(C(=O)NC(C)C)cn2)CC1.
What is the InChIKey of 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide?
The InChIKey is QAKRQIFXEJUCIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-4-18-5-7-19(8-6-18)13-10-15-12(9-16-13)14(20)17-11(2)3/h9-11H,4-8H2,1-3H3,(H,17,20).
What are the key properties of 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide?
5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylpiperazin-1-yl)-N-propan-2-ylpyrazine-2-carboxamide is sourced from PubChem (CID 109271173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).