4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one

C15H19N5O3 — CID 123860239

IUPAC4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one
SMILESCOCC(=O)N1CCC(Nc2nc(=O)[nH]c3ncccc23)CC1
InChIInChI=1S/C15H19N5O3/c1-23-9-12(21)20-7-4-10(5-8-20)17-14-11-3-2-6-16-13(11)18-15(22)19-14/h2-3,6,10H,4-5,7-9H2,1H3,(H2,16,17,18,19,22)
InChIKeyUFGZNOUAGCRMIF-UHFFFAOYSA-N
MW317.35 g/mol
LogP0.37
Rot. Bonds4

About 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one

4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one (PubChem CID 123860239) has the molecular formula C15H19N5O3 and a molecular weight of 317.35 g/mol. Its IUPAC name is 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one.

Molecular Properties

Compound Name4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one
PubChem CID123860239
Molecular FormulaC15H19N5O3
Molecular Weight317.35 g/mol
Exact Mass317.15
IUPAC Name4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one
SMILESCOCC(=O)N1CCC(Nc2nc(=O)[nH]c3ncccc23)CC1
InChIInChI=1S/C15H19N5O3/c1-23-9-12(21)20-7-4-10(5-8-20)17-14-11-3-2-6-16-13(11)18-15(22)19-14/h2-3,6,10H,4-5,7-9H2,1H3,(H2,16,17,18,19,22)
InChIKeyUFGZNOUAGCRMIF-UHFFFAOYSA-N
XLogP0.37
TPSA100.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one with MolForge

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Related Compounds

3-[1-(2-methoxyacetyl)piperidin-4-yl]pyrido[2,3-d]pyrimidin-4-one
CID 121021733
4-[(1-acetylpiperidin-4-yl)amino]-1-hydroxypyrido[2,3-d]pyrimidin-2-one
CID 53258698
7-[(3S)-1-(2-methoxyacetyl)pyrrolidin-3-yl]-6H-1,6-naphthyridin-5-one
CID 92610698
3-methoxy-1-[4-[(2-pyridin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]piperidin-1-yl]propan-1-one
CID 133377520
N-[1-(2-methoxyacetyl)piperidin-4-yl]-3-(pyridine-2-carbonylamino)pyrazine-2-carboxamide
CID 42866695
2-methoxy-N-[[2-[4-(2-methoxyacetyl)piperazin-1-yl]-3-pyridinyl]methyl]acetamide
CID 71876650
4-(cyclopropylamino)-2-[4-[4-(2-methoxyacetyl)piperazin-1-yl]anilino]pyrimidine-5-carboxamide
CID 44594663
1-[4-[3-(cyclopentylamino)imidazo[1,2-a]pyridin-2-yl]piperidin-1-yl]-2-methoxyethanone
CID 46955549
2-methoxy-1-[4-(2-methylpyrimidin-4-yl)oxypiperidin-1-yl]ethanone
CID 121162400
1-[4-(pyrimidin-2-ylamino)piperidin-1-yl]propan-1-one
CID 176934296
2-methoxy-1-[4-[2-[3-(quinolin-2-ylamino)cyclobutyl]oxy-3-pyridinyl]piperidin-1-yl]ethanone
CID 54759926
2-methoxy-1-[4-(3-methylphenoxy)piperidin-1-yl]ethanone
CID 70746806

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one?
The IUPAC name of 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one (CID 123860239) is 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one.
What is the SMILES notation for 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one?
The canonical SMILES for 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one is COCC(=O)N1CCC(Nc2nc(=O)[nH]c3ncccc23)CC1.
What is the InChIKey of 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one?
The InChIKey is UFGZNOUAGCRMIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3/c1-23-9-12(21)20-7-4-10(5-8-20)17-14-11-3-2-6-16-13(11)18-15(22)19-14/h2-3,6,10H,4-5,7-9H2,1H3,(H2,16,17,18,19,22).
What are the key properties of 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one?
4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one has a molecular weight of 317.35 g/mol, XLogP of 0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(2-methoxyacetyl)piperidin-4-yl]amino]-1H-pyrido[2,3-d]pyrimidin-2-one is sourced from PubChem (CID 123860239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).