4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine

C17H26N2 — CID 134484899

IUPAC4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine
SMILESCCCC1=C(C)N=C2C(CC)CCCN2C1=C1CC1
InChIInChI=1S/C17H26N2/c1-4-7-15-12(3)18-17-13(5-2)8-6-11-19(17)16(15)14-9-10-14/h13H,4-11H2,1-3H3
InChIKeyHOIXUUFYIKVUPJ-UHFFFAOYSA-N
MW258.41 g/mol
LogP4.64
Rot. Bonds3

About 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine

4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine (PubChem CID 134484899) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine.

Molecular Properties

Compound Name4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine
PubChem CID134484899
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine
SMILESCCCC1=C(C)N=C2C(CC)CCCN2C1=C1CC1
InChIInChI=1S/C17H26N2/c1-4-7-15-12(3)18-17-13(5-2)8-6-11-19(17)16(15)14-9-10-14/h13H,4-11H2,1-3H3
InChIKeyHOIXUUFYIKVUPJ-UHFFFAOYSA-N
XLogP4.64
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine?
The IUPAC name of 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine (CID 134484899) is 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine.
What is the SMILES notation for 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine?
The canonical SMILES for 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine is CCCC1=C(C)N=C2C(CC)CCCN2C1=C1CC1.
What is the InChIKey of 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine?
The InChIKey is HOIXUUFYIKVUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-4-7-15-12(3)18-17-13(5-2)8-6-11-19(17)16(15)14-9-10-14/h13H,4-11H2,1-3H3.
What are the key properties of 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine?
4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine has a molecular weight of 258.41 g/mol, XLogP of 4.64, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropylidene-9-ethyl-2-methyl-3-propyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidine is sourced from PubChem (CID 134484899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).