1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine

C8H16N2 — CID 67182409

IUPAC1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine
SMILESCCN1C=CCN(C)C1C
InChIInChI=1S/C8H16N2/c1-4-10-7-5-6-9(3)8(10)2/h5,7-8H,4,6H2,1-3H3
InChIKeyXOGMMIWMBYTXCX-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.11
Rot. Bonds1

About 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine

1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine (PubChem CID 67182409) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine.

Molecular Properties

Compound Name1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine
PubChem CID67182409
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine
SMILESCCN1C=CCN(C)C1C
InChIInChI=1S/C8H16N2/c1-4-10-7-5-6-9(3)8(10)2/h5,7-8H,4,6H2,1-3H3
InChIKeyXOGMMIWMBYTXCX-UHFFFAOYSA-N
XLogP1.11
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine with MolForge

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

Launch Full Analysis

Related Compounds

1,3-Dimethylpyrimidine
CID 19432557
1-N,1-N,1-N',1-N'-tetraethylprop-1-ene-1,1-diamine
CID 12284042
1-Allyl-3-methyl imidazole
CID 19927377
1-Allyl-3-butyl imidazole
CID 23154601
1-Allyl-3-vinylimidazole
CID 23154610
1-ethyl-3-prop-2-enyl-2H-imidazole
CID 23154613
1-prop-2-enyl-3-propyl-2H-imidazole
CID 23154622
2-Fluoro-1,3-dimethyl-2,4-dihydropyrimidine
CID 150760065
1,3-Dibutyl-2,4-dihydropyrimidine
CID 226446
Bis(diallylamino)methane
CID 233713
(E)-1-N,1-N,1-N',1-N',3-N,3-N-hexamethylprop-2-ene-1,1,3-triamine
CID 12662339
1,3,5-Triallyl-2,4,6-trimethylhexahydro-sym-triazine
CID 23264140

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine?
The IUPAC name of 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine (CID 67182409) is 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine.
What is the SMILES notation for 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine?
The canonical SMILES for 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine is CCN1C=CCN(C)C1C.
What is the InChIKey of 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine?
The InChIKey is XOGMMIWMBYTXCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-10-7-5-6-9(3)8(10)2/h5,7-8H,4,6H2,1-3H3.
What are the key properties of 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine?
1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine has a molecular weight of 140.23 g/mol, XLogP of 1.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,3-dimethyl-2,4-dihydropyrimidine is sourced from PubChem (CID 67182409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).