2-methyl-6-propan-2-yl-4,5-dihydropyrimidine

C8H14N2 — CID 146204571

IUPAC2-methyl-6-propan-2-yl-4,5-dihydropyrimidine
SMILESCC1=NCCC(C(C)C)=N1
InChIInChI=1S/C8H14N2/c1-6(2)8-4-5-9-7(3)10-8/h6H,4-5H2,1-3H3
InChIKeyIRXRDLRUBUEXCD-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.91
Rot. Bonds1

About 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine

2-methyl-6-propan-2-yl-4,5-dihydropyrimidine (PubChem CID 146204571) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine.

Molecular Properties

Compound Name2-methyl-6-propan-2-yl-4,5-dihydropyrimidine
PubChem CID146204571
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-methyl-6-propan-2-yl-4,5-dihydropyrimidine
SMILESCC1=NCCC(C(C)C)=N1
InChIInChI=1S/C8H14N2/c1-6(2)8-4-5-9-7(3)10-8/h6H,4-5H2,1-3H3
InChIKeyIRXRDLRUBUEXCD-UHFFFAOYSA-N
XLogP1.91
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,6-dimethyl-5-propan-2-yl-2,3-dihydropyridine
CID 123661159
6-methyl-4-propan-2-yl-2,3-dihydropyridine
CID 123604478
N,N'-dimethyl-N'-(6-methyl-2-propan-2-yl-3,4-dihydropyridin-5-yl)ethane-1,2-diamine
CID 142358586
3,5-di(propan-2-yl)-4H-pyrazole
CID 58961217
3-propan-2-yl-2-azabicyclo[3.2.0]hepta-1(5),2-diene
CID 167590032
3-ethenyl-5-propan-2-yl-4H-pyrazole
CID 174343764
5-propan-2-yl-3,4-dihydro-2H-pyrrole;1-propan-2-ylpiperidine
CID 159231383
3-propan-2-yl-4,5-dihydro-1H-pyrazole
CID 58111212
4-propan-2-yl-2,5-dihydro-1,3-oxazole
CID 22898643
5-propan-2-yl-6,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
CID 45096231
2,5-dimethyl-4H-imidazole;ethane
CID 123961103
8-propan-2-yl-5,6-dihydro-1,7-naphthyridine
CID 174911896

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine?
The IUPAC name of 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine (CID 146204571) is 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine.
What is the SMILES notation for 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine?
The canonical SMILES for 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine is CC1=NCCC(C(C)C)=N1.
What is the InChIKey of 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine?
The InChIKey is IRXRDLRUBUEXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-6(2)8-4-5-9-7(3)10-8/h6H,4-5H2,1-3H3.
What are the key properties of 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine?
2-methyl-6-propan-2-yl-4,5-dihydropyrimidine has a molecular weight of 138.21 g/mol, XLogP of 1.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propan-2-yl-4,5-dihydropyrimidine is sourced from PubChem (CID 146204571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).