5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide

C17H27N5O2 — CID 109279210

IUPAC5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(N2CCN(C(C)=O)CC2)cn1
InChIInChI=1S/C17H27N5O2/c1-4-6-22(7-5-2)17(24)15-12-19-16(13-18-15)21-10-8-20(9-11-21)14(3)23/h12-13H,4-11H2,1-3H3
InChIKeyPOKDXFJMHIQNJM-UHFFFAOYSA-N
MW333.44 g/mol
LogP1.41
Rot. Bonds6

About 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide

5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide (PubChem CID 109279210) has the molecular formula C17H27N5O2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide
PubChem CID109279210
Molecular FormulaC17H27N5O2
Molecular Weight333.44 g/mol
Exact Mass333.22
IUPAC Name5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cnc(N2CCN(C(C)=O)CC2)cn1
InChIInChI=1S/C17H27N5O2/c1-4-6-22(7-5-2)17(24)15-12-19-16(13-18-15)21-10-8-20(9-11-21)14(3)23/h12-13H,4-11H2,1-3H3
InChIKeyPOKDXFJMHIQNJM-UHFFFAOYSA-N
XLogP1.41
TPSA69.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-[5-(dipropylcarbamoyl)pyrazin-2-yl]piperazine-1-carboxylate
CID 109286321
5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyridine-2-carboxamide
CID 109187393
5-(2,3-dihydroindol-1-yl)-N,N-dipropylpyrazine-2-carboxamide
CID 109288910
5-(4-acetylpiperazin-1-yl)-N-(1,1-dioxothiolan-3-yl)-N-methylpyrazine-2-carboxamide
CID 109279189
4-(4-acetylpiperazine-1-carbonyl)-N,N-dipropylpyridine-2-carboxamide
CID 109084882
N-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-5-methyl-N-propylpyrazine-2-carboxamide
CID 3533297
ethyl 4-[3-[(5-methylpyrazine-2-carbonyl)-propylamino]propanoyl]piperazine-1-carboxylate
CID 4658031
N-butyl-N-methyl-5-morpholin-4-ylpyrazine-2-carboxamide
CID 109276632
N-[3-[4-(2-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-5-methyl-N-propylpyrazine-2-carboxamide
CID 5151128
[5-(4-ethylpiperazin-1-yl)pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 109273513
N-butyl-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109272354
N-butyl-5-[4-(furan-2-carbonyl)piperazin-1-yl]-N-methylpyrazine-2-carboxamide
CID 109286550

Frequently Asked Questions

What is the IUPAC name of 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide?
The IUPAC name of 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide (CID 109279210) is 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide?
The canonical SMILES for 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide is CCCN(CCC)C(=O)c1cnc(N2CCN(C(C)=O)CC2)cn1.
What is the InChIKey of 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide?
The InChIKey is POKDXFJMHIQNJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5O2/c1-4-6-22(7-5-2)17(24)15-12-19-16(13-18-15)21-10-8-20(9-11-21)14(3)23/h12-13H,4-11H2,1-3H3.
What are the key properties of 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide?
5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide has a molecular weight of 333.44 g/mol, XLogP of 1.41, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide is sourced from PubChem (CID 109279210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).