1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one

C9H11FN2O — CID 167308629

IUPAC1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one
SMILESCNc1cccn(C2C[C@H]2F)c1=O
InChIInChI=1S/C9H11FN2O/c1-11-7-3-2-4-12(9(7)13)8-5-6(8)10/h2-4,6,8,11H,5H2,1H3/t6-,8?/m1/s1
InChIKeyQCUPWAFOVCAQAV-XPJFZRNWSA-N
MW182.20 g/mol
LogP1.17
Rot. Bonds2

About 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one

1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one (PubChem CID 167308629) has the molecular formula C9H11FN2O and a molecular weight of 182.20 g/mol. Its IUPAC name is 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one.

Molecular Properties

Compound Name1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one
PubChem CID167308629
Molecular FormulaC9H11FN2O
Molecular Weight182.20 g/mol
Exact Mass182.09
IUPAC Name1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one
SMILESCNc1cccn(C2C[C@H]2F)c1=O
InChIInChI=1S/C9H11FN2O/c1-11-7-3-2-4-12(9(7)13)8-5-6(8)10/h2-4,6,8,11H,5H2,1H3/t6-,8?/m1/s1
InChIKeyQCUPWAFOVCAQAV-XPJFZRNWSA-N
XLogP1.17
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1R,2R)-2-methoxycyclopropyl]-3-(methylamino)pyridin-2-one
CID 137449559
3-amino-1-[(2R)-2-fluorocyclopropyl]pyridin-2-one;hydrochloride
CID 162319124
1-(4-hydroxycyclohexyl)-3-(methylamino)pyridin-2-one
CID 137449098
3-(methylamino)-1-[(3S)-oxan-3-yl]pyridin-2-one
CID 139373545
N-[(2R)-2-fluorocyclobutyl]-5-[[1-[(1S,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146559152
5-[[1-[(1R,2R)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-N-[(1S,2S)-2-hydroxycyclobutyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137450055
1-[(1S,2S)-2-methoxycyclopropyl]-3-(propan-2-ylamino)pyridin-2-one
CID 137457494
5-[[1-[(1S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-N-(3-hydroxy-2,2-dimethylpropyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146383474
5-[[1-[(2R)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-N-(3-hydroxy-2,2-dimethylpropyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137450194
5-[[1-[(1R,2R)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-N-[(1R,3S)-3-hydroxycyclopentyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137450177
1-[(1S,2R)-2-hydroxycyclopentyl]-3-(propan-2-ylamino)pyridin-2-one
CID 139373552
5-[[1-[(1S,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-N-[[1-(hydroxymethyl)cyclopropyl]methyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137441571

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one?
The IUPAC name of 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one (CID 167308629) is 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one.
What is the SMILES notation for 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one?
The canonical SMILES for 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one is CNc1cccn(C2C[C@H]2F)c1=O.
What is the InChIKey of 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one?
The InChIKey is QCUPWAFOVCAQAV-XPJFZRNWSA-N. The full InChI is InChI=1S/C9H11FN2O/c1-11-7-3-2-4-12(9(7)13)8-5-6(8)10/h2-4,6,8,11H,5H2,1H3/t6-,8?/m1/s1.
What are the key properties of 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one?
1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one has a molecular weight of 182.20 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-fluorocyclopropyl]-3-(methylamino)pyridin-2-one is sourced from PubChem (CID 167308629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).