5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one

C16H15FN4O2 — CID 59749154

IUPAC5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one
SMILESNc1ncc(-c2ccc(=O)n(CCCF)c2)c(-c2ccco2)n1
InChIInChI=1S/C16H15FN4O2/c17-6-2-7-21-10-11(4-5-14(21)22)12-9-19-16(18)20-15(12)13-3-1-8-23-13/h1,3-5,8-10H,2,6-7H2,(H2,18,19,20)
InChIKeySUWRTGZCPNRRNT-UHFFFAOYSA-N
MW314.32 g/mol
LogP2.51
Rot. Bonds5

About 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one

5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one (PubChem CID 59749154) has the molecular formula C16H15FN4O2 and a molecular weight of 314.32 g/mol. Its IUPAC name is 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one.

Molecular Properties

Compound Name5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one
PubChem CID59749154
Molecular FormulaC16H15FN4O2
Molecular Weight314.32 g/mol
Exact Mass314.12
IUPAC Name5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one
SMILESNc1ncc(-c2ccc(=O)n(CCCF)c2)c(-c2ccco2)n1
InChIInChI=1S/C16H15FN4O2/c17-6-2-7-21-10-11(4-5-14(21)22)12-9-19-16(18)20-15(12)13-3-1-8-23-13/h1,3-5,8-10H,2,6-7H2,(H2,18,19,20)
InChIKeySUWRTGZCPNRRNT-UHFFFAOYSA-N
XLogP2.51
TPSA86.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(2-hydroxyethyl)pyridin-2-one
CID 59749146
5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(2-pyrrol-1-ylethyl)pyridin-2-one
CID 59749096
2-[5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-2-oxo-1-pyridinyl]acetamide
CID 59749186
5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-methylpyridin-2-one;methanesulfonic acid
CID 24798371
4-(furan-2-yl)-5-phenylpyrimidin-2-amine
CID 134140522
4-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-[2-(diethylamino)ethyl]pyridin-2-one
CID 59749176
4-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-but-2-ynylpyridin-2-one
CID 59749102
2-amino-6-(furan-2-yl)-5-[1-(3-hydroxypropyl)-6-oxo-3-pyridinyl]pyridine-3-carbonitrile
CID 22708093
2-amino-5-(1-butyl-6-oxo-3-pyridinyl)-6-(furan-2-yl)pyridine-3-carbonitrile
CID 22708131
4-(furan-2-yl)-5-(4-methylquinazolin-6-yl)pyrimidin-2-amine
CID 146299644
4-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-[[3-(1,1-difluoroethyl)cyclohexa-1,5-dien-1-yl]methyl]pyridin-2-one
CID 162557297
2-amino-N-[3-(diethylamino)propyl]-5-(1-ethyl-6-oxo-3-pyridinyl)-6-(furan-2-yl)pyridine-3-carboxamide
CID 22708095

Frequently Asked Questions

What is the IUPAC name of 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one?
The IUPAC name of 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one (CID 59749154) is 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one.
What is the SMILES notation for 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one?
The canonical SMILES for 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one is Nc1ncc(-c2ccc(=O)n(CCCF)c2)c(-c2ccco2)n1.
What is the InChIKey of 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one?
The InChIKey is SUWRTGZCPNRRNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN4O2/c17-6-2-7-21-10-11(4-5-14(21)22)12-9-19-16(18)20-15(12)13-3-1-8-23-13/h1,3-5,8-10H,2,6-7H2,(H2,18,19,20).
What are the key properties of 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one?
5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one has a molecular weight of 314.32 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-amino-4-(furan-2-yl)pyrimidin-5-yl]-1-(3-fluoropropyl)pyridin-2-one is sourced from PubChem (CID 59749154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).