8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine

C10H15N3 — CID 123943619

IUPAC8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine
SMILESCCN1C=CCC2=C(C)NC=NC21
InChIInChI=1S/C10H15N3/c1-3-13-6-4-5-9-8(2)11-7-12-10(9)13/h4,6-7,10H,3,5H2,1-2H3,(H,11,12)
InChIKeyNXWBPRLBLPFDGG-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.46
Rot. Bonds1

About 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine

8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine (PubChem CID 123943619) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine.

Molecular Properties

Compound Name8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine
PubChem CID123943619
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine
SMILESCCN1C=CCC2=C(C)NC=NC21
InChIInChI=1S/C10H15N3/c1-3-13-6-4-5-9-8(2)11-7-12-10(9)13/h4,6-7,10H,3,5H2,1-2H3,(H,11,12)
InChIKeyNXWBPRLBLPFDGG-UHFFFAOYSA-N
XLogP1.46
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine?
The IUPAC name of 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine (CID 123943619) is 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine.
What is the SMILES notation for 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine?
The canonical SMILES for 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine is CCN1C=CCC2=C(C)NC=NC21.
What is the InChIKey of 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine?
The InChIKey is NXWBPRLBLPFDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-3-13-6-4-5-9-8(2)11-7-12-10(9)13/h4,6-7,10H,3,5H2,1-2H3,(H,11,12).
What are the key properties of 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine?
8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine has a molecular weight of 177.25 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-4-methyl-5,8a-dihydro-3H-pyrido[2,3-d]pyrimidine is sourced from PubChem (CID 123943619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).