2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium

C7H11N2ORh- — CID 59872620

IUPAC2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium
SMILESCC(C)C1=NCCC(=O)[N-]1.[Rh]
InChIInChI=1S/C7H12N2O.Rh/c1-5(2)7-8-4-3-6(10)9-7;/h5H,3-4H2,1-2H3,(H,8,9,10);/p-1
InChIKeyDVOPONGPZHULKA-UHFFFAOYSA-M
MW242.08 g/mol
LogP1.34
Rot. Bonds1

About 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium

2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium (PubChem CID 59872620) has the molecular formula C7H11N2ORh- and a molecular weight of 242.08 g/mol. Its IUPAC name is 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium.

Molecular Properties

Compound Name2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium
PubChem CID59872620
Molecular FormulaC7H11N2ORh-
Molecular Weight242.08 g/mol
Exact Mass241.99
IUPAC Name2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium
SMILESCC(C)C1=NCCC(=O)[N-]1.[Rh]
InChIInChI=1S/C7H12N2O.Rh/c1-5(2)7-8-4-3-6(10)9-7;/h5H,3-4H2,1-2H3,(H,8,9,10);/p-1
InChIKeyDVOPONGPZHULKA-UHFFFAOYSA-M
XLogP1.34
TPSA43.53 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.08
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-Dimethyl-4,5-dihydropyrimidin-6-one
CID 20707762
1-Ethyl-2-methyl-4,5-dihydropyrimidin-6-one
CID 21720732
2-propan-2-yl-4,5-dihydro-1H-pyrimidin-6-one
CID 22898627
2,5-dimethyl-4,5-dihydro-1H-pyrimidin-6-one
CID 55287748
2-ethyl-4,5-dihydro-1H-pyrimidin-6-one
CID 69298206
1,2,5-Trimethyl-4,5-dihydropyrimidin-6-one
CID 123962511
2-Propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium(2+)
CID 22898626

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium?
The IUPAC name of 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium (CID 59872620) is 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium.
What is the SMILES notation for 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium?
The canonical SMILES for 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium is CC(C)C1=NCCC(=O)[N-]1.[Rh].
What is the InChIKey of 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium?
The InChIKey is DVOPONGPZHULKA-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H12N2O.Rh/c1-5(2)7-8-4-3-6(10)9-7;/h5H,3-4H2,1-2H3,(H,8,9,10);/p-1.
What are the key properties of 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium?
2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium has a molecular weight of 242.08 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-4,5-dihydropyrimidin-1-id-6-one;rhodium is sourced from PubChem (CID 59872620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).