N-carbamoylbenzamide;urea

C9H12N4O3 — CID 157303801

IUPACN-carbamoylbenzamide;urea
SMILESNC(=O)NC(=O)c1ccccc1.NC(N)=O
InChIInChI=1S/C8H8N2O2.CH4N2O/c9-8(12)10-7(11)6-4-2-1-3-5-6;2-1(3)4/h1-5H,(H3,9,10,11,12);(H4,2,3,4)
InChIKeyBCFCHTYEFWVNSQ-UHFFFAOYSA-N
MW224.22 g/mol
LogP-0.48
Rot. Bonds1

About N-carbamoylbenzamide;urea

N-carbamoylbenzamide;urea (PubChem CID 157303801) has the molecular formula C9H12N4O3 and a molecular weight of 224.22 g/mol. Its IUPAC name is N-carbamoylbenzamide;urea.

Molecular Properties

Compound NameN-carbamoylbenzamide;urea
PubChem CID157303801
Molecular FormulaC9H12N4O3
Molecular Weight224.22 g/mol
Exact Mass224.09
IUPAC NameN-carbamoylbenzamide;urea
SMILESNC(=O)NC(=O)c1ccccc1.NC(N)=O
InChIInChI=1S/C8H8N2O2.CH4N2O/c9-8(12)10-7(11)6-4-2-1-3-5-6;2-1(3)4/h1-5H,(H3,9,10,11,12);(H4,2,3,4)
InChIKeyBCFCHTYEFWVNSQ-UHFFFAOYSA-N
XLogP-0.48
TPSA141.30 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 5-0.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

N-carbamoylbenzamide;1,3,4-thiadiazole
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N-methylbenzamide
CID 11954
N-(3-amino-1-chloro-3-oxo-1-phenylprop-1-en-2-yl)benzamide
CID 141166419
N-(diaminomethylideneamino)benzamide;hydrochloride
CID 156587607
benzohydrazide;molybdenum
CID 162076561
N-(benzoylcarbamothioyl)benzamide;ethene
CID 157078951
N-carbamoyl-2-[2-(carbamoylcarbamoyl)phenyl]benzamide
CID 70008236
N-(diaminomethylideneamino)sulfonylcarbonylbenzamide
CID 90866309
N-methylbenzamide;molecular hydrogen
CID 142972595
lithium;hydride;N-methylbenzamide
CID 173287348

Frequently Asked Questions

What is the IUPAC name of N-carbamoylbenzamide;urea?
The IUPAC name of N-carbamoylbenzamide;urea (CID 157303801) is N-carbamoylbenzamide;urea.
What is the SMILES notation for N-carbamoylbenzamide;urea?
The canonical SMILES for N-carbamoylbenzamide;urea is NC(=O)NC(=O)c1ccccc1.NC(N)=O.
What is the InChIKey of N-carbamoylbenzamide;urea?
The InChIKey is BCFCHTYEFWVNSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2.CH4N2O/c9-8(12)10-7(11)6-4-2-1-3-5-6;2-1(3)4/h1-5H,(H3,9,10,11,12);(H4,2,3,4).
What are the key properties of N-carbamoylbenzamide;urea?
N-carbamoylbenzamide;urea has a molecular weight of 224.22 g/mol, XLogP of -0.48, 1 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoylbenzamide;urea is sourced from PubChem (CID 157303801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).