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

C10H16N2 — CID 154164313

IUPAC6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine
SMILESCC1=CC(C)(C)C2=NCCCN12
InChIInChI=1S/C10H16N2/c1-8-7-10(2,3)9-11-5-4-6-12(8)9/h7H,4-6H2,1-3H3
InChIKeyXKFBBMAYTJULCF-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.03
Rot. Bonds

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

6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine (PubChem CID 154164313) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine.

Molecular Properties

Compound Name6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine
PubChem CID154164313
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine
SMILESCC1=CC(C)(C)C2=NCCCN12
InChIInChI=1S/C10H16N2/c1-8-7-10(2,3)9-11-5-4-6-12(8)9/h7H,4-6H2,1-3H3
InChIKeyXKFBBMAYTJULCF-UHFFFAOYSA-N
XLogP2.03
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methyl-2-[(1-methyl-2,3-dihydropyrrol-5-yl)methyl]-4,5-dihydroimidazole
CID 20692436
5,7-Ditert-butyl-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidine
CID 138722622
5,7,7-Trimethyl-2,3-dihydropyrrolo[1,2-a]imidazole
CID 154090366
N,1-dibutyl-3,3,5-trimethylpyrrol-2-imine
CID 154091731
N,N-diethyl-6-methyl-3,4-dihydropyridin-2-amine
CID 156227017
3-methyl-2,6-di(propan-2-yl)-4H-pyrimidine
CID 156306574
N'-but-1-en-2-yl-N-methyl-N-[(Z)-pent-3-enyl]propanimidamide
CID 166814571
2,3-Ditert-butyl-6-methylidene-4,5-dihydropyrimidine
CID 169872785

Frequently Asked Questions

What is the IUPAC name of 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine?
The IUPAC name of 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine (CID 154164313) is 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine.
What is the SMILES notation for 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine?
The canonical SMILES for 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine is CC1=CC(C)(C)C2=NCCCN12.
What is the InChIKey of 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine?
The InChIKey is XKFBBMAYTJULCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8-7-10(2,3)9-11-5-4-6-12(8)9/h7H,4-6H2,1-3H3.
What are the key properties of 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine?
6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine has a molecular weight of 164.25 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8,8-trimethyl-3,4-dihydro-2H-pyrrolo[1,2-a]pyrimidine is sourced from PubChem (CID 154164313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).