7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine

C10H18N2 — CID 23050697

IUPAC7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine
SMILESCC1C2=NCCCN2CC1(C)C
InChIInChI=1S/C10H18N2/c1-8-9-11-5-4-6-12(9)7-10(8,2)3/h8H,4-7H2,1-3H3
InChIKeyDBEGOQDBVDTFOH-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.77
Rot. Bonds

About 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine

7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine (PubChem CID 23050697) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine.

Molecular Properties

Compound Name7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine
PubChem CID23050697
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine
SMILESCC1C2=NCCCN2CC1(C)C
InChIInChI=1S/C10H18N2/c1-8-9-11-5-4-6-12(9)7-10(8,2)3/h8H,4-7H2,1-3H3
InChIKeyDBEGOQDBVDTFOH-UHFFFAOYSA-N
XLogP1.77
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine?
The IUPAC name of 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine (CID 23050697) is 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine.
What is the SMILES notation for 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine?
The canonical SMILES for 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine is CC1C2=NCCCN2CC1(C)C.
What is the InChIKey of 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine?
The InChIKey is DBEGOQDBVDTFOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-8-9-11-5-4-6-12(9)7-10(8,2)3/h8H,4-7H2,1-3H3.
What are the key properties of 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine?
7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine has a molecular weight of 166.27 g/mol, XLogP of 1.77, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7,8-trimethyl-3,4,6,8-tetrahydro-2H-pyrrolo[1,2-a]pyrimidine is sourced from PubChem (CID 23050697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).