3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one

C12H18N4O — CID 80817247

IUPAC3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one
SMILESCCNc1cccc(NC2CCCNC2=O)n1
InChIInChI=1S/C12H18N4O/c1-2-13-10-6-3-7-11(16-10)15-9-5-4-8-14-12(9)17/h3,6-7,9H,2,4-5,8H2,1H3,(H,14,17)(H2,13,15,16)
InChIKeyCCTVBHWXONSOQZ-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.20
Rot. Bonds4

About 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one

3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one (PubChem CID 80817247) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one.

Molecular Properties

Compound Name3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one
PubChem CID80817247
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one
SMILESCCNc1cccc(NC2CCCNC2=O)n1
InChIInChI=1S/C12H18N4O/c1-2-13-10-6-3-7-11(16-10)15-9-5-4-8-14-12(9)17/h3,6-7,9H,2,4-5,8H2,1H3,(H,14,17)(H2,13,15,16)
InChIKeyCCTVBHWXONSOQZ-UHFFFAOYSA-N
XLogP1.20
TPSA66.05 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]piperidin-2-one
CID 80954552
3-[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]piperidin-2-one
CID 80957227
3-(quinolin-2-ylamino)piperidin-2-one
CID 62091961
3-[(2-chloropyrimidin-4-yl)amino]piperidin-2-one
CID 62341701
3-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]piperidin-2-one
CID 80817246
3-[[6-(ethylamino)-2-pyridinyl]amino]-1-methylpyrrolidine-2,5-dione
CID 80856588
3-(pyrimidin-4-ylamino)piperidin-2-one
CID 62093434
2-N-ethyl-6-N-(3-methylcyclohexyl)pyridine-2,6-diamine
CID 80782760
3-[[3,5-dichloro-6-(propylamino)-2-pyridinyl]amino]piperidin-2-one
CID 102757774
2-(ethylamino)-3-fluoro-N-(2-oxopiperidin-3-yl)benzamide
CID 62662588
3-[(6-propoxypyrimidin-4-yl)amino]piperidin-2-one
CID 66330181
3-(1-naphthalen-1-ylethylamino)piperidin-2-one
CID 62094476

Frequently Asked Questions

What is the IUPAC name of 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one?
The IUPAC name of 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one (CID 80817247) is 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one.
What is the SMILES notation for 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one?
The canonical SMILES for 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one is CCNc1cccc(NC2CCCNC2=O)n1.
What is the InChIKey of 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one?
The InChIKey is CCTVBHWXONSOQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-2-13-10-6-3-7-11(16-10)15-9-5-4-8-14-12(9)17/h3,6-7,9H,2,4-5,8H2,1H3,(H,14,17)(H2,13,15,16).
What are the key properties of 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one?
3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one has a molecular weight of 234.30 g/mol, XLogP of 1.20, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[6-(ethylamino)-2-pyridinyl]amino]piperidin-2-one is sourced from PubChem (CID 80817247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).