1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine

C15H24N4O — CID 118739315

IUPAC1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine
SMILESCCN1CCC2(COCc3c(C)nc(N(C)C)nc32)C1
InChIInChI=1S/C15H24N4O/c1-5-19-7-6-15(9-19)10-20-8-12-11(2)16-14(18(3)4)17-13(12)15/h5-10H2,1-4H3
InChIKeyIKYWVZIEWBTCAP-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.34
Rot. Bonds2

About 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine

1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine (PubChem CID 118739315) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine.

Molecular Properties

Compound Name1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine
PubChem CID118739315
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine
SMILESCCN1CCC2(COCc3c(C)nc(N(C)C)nc32)C1
InChIInChI=1S/C15H24N4O/c1-5-19-7-6-15(9-19)10-20-8-12-11(2)16-14(18(3)4)17-13(12)15/h5-10H2,1-4H3
InChIKeyIKYWVZIEWBTCAP-UHFFFAOYSA-N
XLogP1.34
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine?
The IUPAC name of 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine (CID 118739315) is 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine.
What is the SMILES notation for 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine?
The canonical SMILES for 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine is CCN1CCC2(COCc3c(C)nc(N(C)C)nc32)C1.
What is the InChIKey of 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine?
The InChIKey is IKYWVZIEWBTCAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-5-19-7-6-15(9-19)10-20-8-12-11(2)16-14(18(3)4)17-13(12)15/h5-10H2,1-4H3.
What are the key properties of 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine?
1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine has a molecular weight of 276.38 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-ethyl-N,N,4-trimethylspiro[5,7-dihydropyrano[4,3-d]pyrimidine-8,3'-pyrrolidine]-2-amine is sourced from PubChem (CID 118739315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).