4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine

C15H16N2 — CID 159861129

IUPAC4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine
SMILESCc1cc2c(c(C)c1C)Cc1ncnc(C)c1-2
InChIInChI=1S/C15H16N2/c1-8-5-13-12(10(3)9(8)2)6-14-15(13)11(4)16-7-17-14/h5,7H,6H2,1-4H3
InChIKeyVZXAAZPAMNVRCW-UHFFFAOYSA-N
MW224.31 g/mol
LogP3.28
Rot. Bonds

About 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine

4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine (PubChem CID 159861129) has the molecular formula C15H16N2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine.

Molecular Properties

Compound Name4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine
PubChem CID159861129
Molecular FormulaC15H16N2
Molecular Weight224.31 g/mol
Exact Mass224.13
IUPAC Name4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine
SMILESCc1cc2c(c(C)c1C)Cc1ncnc(C)c1-2
InChIInChI=1S/C15H16N2/c1-8-5-13-12(10(3)9(8)2)6-14-15(13)11(4)16-7-17-14/h5,7H,6H2,1-4H3
InChIKeyVZXAAZPAMNVRCW-UHFFFAOYSA-N
XLogP3.28
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine?
The IUPAC name of 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine (CID 159861129) is 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine.
What is the SMILES notation for 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine?
The canonical SMILES for 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine is Cc1cc2c(c(C)c1C)Cc1ncnc(C)c1-2.
What is the InChIKey of 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine?
The InChIKey is VZXAAZPAMNVRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2/c1-8-5-13-12(10(3)9(8)2)6-14-15(13)11(4)16-7-17-14/h5,7H,6H2,1-4H3.
What are the key properties of 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine?
4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine has a molecular weight of 224.31 g/mol, XLogP of 3.28, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6,7,8-tetramethyl-9H-indeno[2,1-d]pyrimidine is sourced from PubChem (CID 159861129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).