1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione

C10H14N2O2 — CID 143872724

IUPAC1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione
SMILESC/C=C\c1c(C)c(=O)[nH]c(=O)n1CC
InChIInChI=1S/C10H14N2O2/c1-4-6-8-7(3)9(13)11-10(14)12(8)5-2/h4,6H,5H2,1-3H3,(H,11,13,14)/b6-4-
InChIKeyCFBQFBJBGREHEA-XQRVVYSFSA-N
MW194.23 g/mol
LogP0.90
Rot. Bonds2

About 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione

1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione (PubChem CID 143872724) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione
PubChem CID143872724
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione
SMILESC/C=C\c1c(C)c(=O)[nH]c(=O)n1CC
InChIInChI=1S/C10H14N2O2/c1-4-6-8-7(3)9(13)11-10(14)12(8)5-2/h4,6H,5H2,1-3H3,(H,11,13,14)/b6-4-
InChIKeyCFBQFBJBGREHEA-XQRVVYSFSA-N
XLogP0.90
TPSA54.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-sec-Butyl-6-methyluracil
CID 100019
Uracil, 3-butyl-6-methyl-
CID 70528
Uracil, 6-methyl-4-propyl-
CID 165610
(E)-N,N-dimethyl-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide
CID 919528
3-Isobutyl-6-methyluracil
CID 103331
1,5,6-Trimethyluracil
CID 22223251
5-Methyl-1-(prop-2-en-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 11367199
1-Butyl-6-methyluracil
CID 12703038
3-Allyl-6-methyluracil
CID 13602047
1-Isobutyl-6-methyl-uracil
CID 13613065
n-Acryloylthymine
CID 13798227
2-Propenamide, N,N-dimethyl-3-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)-, (E)-
CID 5925971

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione?
The IUPAC name of 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione (CID 143872724) is 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione.
What is the SMILES notation for 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione?
The canonical SMILES for 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione is C/C=C\c1c(C)c(=O)[nH]c(=O)n1CC.
What is the InChIKey of 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione?
The InChIKey is CFBQFBJBGREHEA-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-4-6-8-7(3)9(13)11-10(14)12(8)5-2/h4,6H,5H2,1-3H3,(H,11,13,14)/b6-4-.
What are the key properties of 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione?
1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione has a molecular weight of 194.23 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methyl-6-[(Z)-prop-1-enyl]pyrimidine-2,4-dione is sourced from PubChem (CID 143872724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).