8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one

C14H18N4O — CID 137384067

IUPAC8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one
SMILESCCNc1nc(C)c2cc(C)c(=O)n(C3CC3)c2n1
InChIInChI=1S/C14H18N4O/c1-4-15-14-16-9(3)11-7-8(2)13(19)18(10-5-6-10)12(11)17-14/h7,10H,4-6H2,1-3H3,(H,15,16,17)
InChIKeyIIZWTHLHRONZKG-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.18
Rot. Bonds3

About 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one

8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one (PubChem CID 137384067) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one
PubChem CID137384067
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one
SMILESCCNc1nc(C)c2cc(C)c(=O)n(C3CC3)c2n1
InChIInChI=1S/C14H18N4O/c1-4-15-14-16-9(3)11-7-8(2)13(19)18(10-5-6-10)12(11)17-14/h7,10H,4-6H2,1-3H3,(H,15,16,17)
InChIKeyIIZWTHLHRONZKG-UHFFFAOYSA-N
XLogP2.18
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one (CID 137384067) is 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one is CCNc1nc(C)c2cc(C)c(=O)n(C3CC3)c2n1.
What is the InChIKey of 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
The InChIKey is IIZWTHLHRONZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-4-15-14-16-9(3)11-7-8(2)13(19)18(10-5-6-10)12(11)17-14/h7,10H,4-6H2,1-3H3,(H,15,16,17).
What are the key properties of 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one?
8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one has a molecular weight of 258.32 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopropyl-2-(ethylamino)-4,6-dimethylpyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 137384067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).