tantalum;urea

CH4N2OTa — CID 159758921

IUPACtantalum;urea
SMILESNC(N)=O.[Ta]
InChIInChI=1S/CH4N2O.Ta/c2-1(3)4;/h(H4,2,3,4);
InChIKeyNEPYHUKVYBHIPL-UHFFFAOYSA-N
MW241.00 g/mol
LogP-0.98
Rot. Bonds

About tantalum;urea

tantalum;urea (PubChem CID 159758921) has the molecular formula CH4N2OTa and a molecular weight of 241.00 g/mol. Its IUPAC name is tantalum;urea.

Molecular Properties

Compound Nametantalum;urea
PubChem CID159758921
Molecular FormulaCH4N2OTa
Molecular Weight241.00 g/mol
Exact Mass240.98
IUPAC Nametantalum;urea
SMILESNC(N)=O.[Ta]
InChIInChI=1S/CH4N2O.Ta/c2-1(3)4;/h(H4,2,3,4);
InChIKeyNEPYHUKVYBHIPL-UHFFFAOYSA-N
XLogP-0.98
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.00
LogP ≤ 5-0.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

diamino(113C)methanone
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azanium urea
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barium(2+);urea
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CID 87675783
CID 87675783
azane;urea
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ruthenium;urea
CID 161030938
lithium urea
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samarium;urea
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niobium;urea
CID 159338844
CID 88605054
CID 88605054
bis(oxygen(2-));titanium(4+);urea
CID 160875609

Frequently Asked Questions

What is the IUPAC name of tantalum;urea?
The IUPAC name of tantalum;urea (CID 159758921) is tantalum;urea.
What is the SMILES notation for tantalum;urea?
The canonical SMILES for tantalum;urea is NC(N)=O.[Ta].
What is the InChIKey of tantalum;urea?
The InChIKey is NEPYHUKVYBHIPL-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4N2O.Ta/c2-1(3)4;/h(H4,2,3,4);.
What are the key properties of tantalum;urea?
tantalum;urea has a molecular weight of 241.00 g/mol, XLogP of -0.98, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tantalum;urea is sourced from PubChem (CID 159758921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).