8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one

C16H24N4O — CID 136619137

IUPAC8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one
SMILESCCNC1N=C(C)c2ccc(=O)n(C3CCCCC3)c2N1
InChIInChI=1S/C16H24N4O/c1-3-17-16-18-11(2)13-9-10-14(21)20(15(13)19-16)12-7-5-4-6-8-12/h9-10,12,16-17,19H,3-8H2,1-2H3
InChIKeyJAGWOHXPTBSMAS-UHFFFAOYSA-N
MW288.40 g/mol
LogP2.48
Rot. Bonds3

About 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one

8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one (PubChem CID 136619137) has the molecular formula C16H24N4O and a molecular weight of 288.40 g/mol. Its IUPAC name is 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one
PubChem CID136619137
Molecular FormulaC16H24N4O
Molecular Weight288.40 g/mol
Exact Mass288.20
IUPAC Name8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one
SMILESCCNC1N=C(C)c2ccc(=O)n(C3CCCCC3)c2N1
InChIInChI=1S/C16H24N4O/c1-3-17-16-18-11(2)13-9-10-14(21)20(15(13)19-16)12-7-5-4-6-8-12/h9-10,12,16-17,19H,3-8H2,1-2H3
InChIKeyJAGWOHXPTBSMAS-UHFFFAOYSA-N
XLogP2.48
TPSA58.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one (CID 136619137) is 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one is CCNC1N=C(C)c2ccc(=O)n(C3CCCCC3)c2N1.
What is the InChIKey of 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one?
The InChIKey is JAGWOHXPTBSMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-3-17-16-18-11(2)13-9-10-14(21)20(15(13)19-16)12-7-5-4-6-8-12/h9-10,12,16-17,19H,3-8H2,1-2H3.
What are the key properties of 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one?
8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one has a molecular weight of 288.40 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclohexyl-2-(ethylamino)-4-methyl-1,2-dihydropyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 136619137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).