6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine

C9H14N2 — CID 59890255

IUPAC6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine
SMILESCC=C(C)C1=CCN=C(C)N1
InChIInChI=1S/C9H14N2/c1-4-7(2)9-5-6-10-8(3)11-9/h4-5H,6H2,1-3H3,(H,10,11)
InChIKeyMUZTYKOYHNJZME-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.86
Rot. Bonds1

About 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine

6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine (PubChem CID 59890255) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine.

Molecular Properties

Compound Name6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine
PubChem CID59890255
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine
SMILESCC=C(C)C1=CCN=C(C)N1
InChIInChI=1S/C9H14N2/c1-4-7(2)9-5-6-10-8(3)11-9/h4-5H,6H2,1-3H3,(H,10,11)
InChIKeyMUZTYKOYHNJZME-UHFFFAOYSA-N
XLogP1.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5E)-5-[(2Z)-2,4-dimethylpenta-2,4-dienylidene]-2-(2,2,2-trifluoroethyl)-1,4-dihydroimidazole
CID 89199717
5-fluoro-2-methyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 142309044
N'-methyl-N-[7-methyl-4-(trifluoromethyl)cyclohepta-1,4,6-trien-1-yl]ethanimidamide
CID 146359518
InChI=1/C8H14N2/c1-6-5-8(3,4)10-7(2)9-6/h5H,1-4H3,(H,9,10
CID 13526003
N'-[(3Z)-2,4-difluorohexa-1,3,5-trien-3-yl]-N-[(3E)-2-methylpenta-1,3-dien-3-yl]ethanimidamide
CID 144199924
6-but-2-en-2-yl-2-methyl-4,5-dihydro-1H-pyrimidin-5-ide;yttrium
CID 59890254
5,6-Di(ethylidene)-2-methyl-1,4-dihydropyrimidine;yttrium
CID 59890257
2,4,6-Trimethyl-1,4-dihydropyrimidine
CID 68611629
(2-methyl-7,7a-dihydro-3H-benzimidazol-5-yl)methanamine
CID 70224389
5-Methyl-2,6-dihydropyrrolo[2,3-b]pyrrole
CID 70640497
N-cyclohexa-1,3-dien-1-yl-N'-[(Z)-hex-4-enyl]ethanimidamide
CID 70875583
2-tert-butyl-5,6-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 89000850

Frequently Asked Questions

What is the IUPAC name of 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine?
The IUPAC name of 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine (CID 59890255) is 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine.
What is the SMILES notation for 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine?
The canonical SMILES for 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine is CC=C(C)C1=CCN=C(C)N1.
What is the InChIKey of 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine?
The InChIKey is MUZTYKOYHNJZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-4-7(2)9-5-6-10-8(3)11-9/h4-5H,6H2,1-3H3,(H,10,11).
What are the key properties of 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine?
6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine has a molecular weight of 150.22 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-but-2-en-2-yl-2-methyl-1,4-dihydropyrimidine is sourced from PubChem (CID 59890255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).