[5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone

C16H25N5O — CID 109274083

IUPAC[5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone
SMILESCCN1CCN(C(=O)c2cnc(NC3CCCC3)cn2)CC1
InChIInChI=1S/C16H25N5O/c1-2-20-7-9-21(10-8-20)16(22)14-11-18-15(12-17-14)19-13-5-3-4-6-13/h11-13H,2-10H2,1H3,(H,18,19)
InChIKeyDDGAJEFSXNDKGT-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.61
Rot. Bonds4

About [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone

[5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone (PubChem CID 109274083) has the molecular formula C16H25N5O and a molecular weight of 303.41 g/mol. Its IUPAC name is [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name[5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone
PubChem CID109274083
Molecular FormulaC16H25N5O
Molecular Weight303.41 g/mol
Exact Mass303.21
IUPAC Name[5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone
SMILESCCN1CCN(C(=O)c2cnc(NC3CCCC3)cn2)CC1
InChIInChI=1S/C16H25N5O/c1-2-20-7-9-21(10-8-20)16(22)14-11-18-15(12-17-14)19-13-5-3-4-6-13/h11-13H,2-10H2,1H3,(H,18,19)
InChIKeyDDGAJEFSXNDKGT-UHFFFAOYSA-N
XLogP1.61
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[5-(cycloheptylamino)pyrazin-2-yl]-(4-methylpiperazin-1-yl)methanone
CID 109278127
(4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
CID 109270974
(5-anilinopyrazin-2-yl)-(4-ethylpiperazin-1-yl)methanone
CID 109278481
(4-ethylpiperazin-1-yl)-[5-(4-fluoroanilino)pyrazin-2-yl]methanone
CID 109278506
(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone
CID 109277598
(4-ethylpiperazin-1-yl)-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]methanone
CID 109275194
[5-(cyclohexylamino)pyrazin-2-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 109274875
[5-(4-ethylpiperazin-1-yl)pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 109273513
[4-[5-(cyclopropylamino)pyrazine-2-carbonyl]piperazin-1-yl]-(furan-2-yl)methanone
CID 109271816
[2-(cyclopropylamino)pyrimidin-4-yl]-(4-ethylpiperazin-1-yl)methanone
CID 109295535
5-(cycloheptylamino)-N-(2-methylpropyl)pyrazine-2-carboxamide
CID 109272801
(4-ethylpiperazin-1-yl)-[5-[2-(2-methoxyphenyl)ethylamino]pyrazin-2-yl]methanone
CID 109278444

Frequently Asked Questions

What is the IUPAC name of [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone?
The IUPAC name of [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone (CID 109274083) is [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone.
What is the SMILES notation for [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone?
The canonical SMILES for [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone is CCN1CCN(C(=O)c2cnc(NC3CCCC3)cn2)CC1.
What is the InChIKey of [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone?
The InChIKey is DDGAJEFSXNDKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O/c1-2-20-7-9-21(10-8-20)16(22)14-11-18-15(12-17-14)19-13-5-3-4-6-13/h11-13H,2-10H2,1H3,(H,18,19).
What are the key properties of [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone?
[5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone has a molecular weight of 303.41 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone is sourced from PubChem (CID 109274083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).