1-carbamoyl-3-pyridin-2-ylurea

C7H8N4O2 — CID 564989

IUPAC1-carbamoyl-3-pyridin-2-ylurea
SMILESNC(=O)NC(=O)Nc1ccccn1
InChIInChI=1S/C7H8N4O2/c8-6(12)11-7(13)10-5-3-1-2-4-9-5/h1-4H,(H4,8,9,10,11,12,13)
InChIKeyJZHDDPZVHRKTSN-UHFFFAOYSA-N
MW180.17 g/mol
LogP0.28
Rot. Bonds1

About 1-carbamoyl-3-pyridin-2-ylurea

1-carbamoyl-3-pyridin-2-ylurea (PubChem CID 564989) has the molecular formula C7H8N4O2 and a molecular weight of 180.17 g/mol. Its IUPAC name is 1-carbamoyl-3-pyridin-2-ylurea.

Molecular Properties

Compound Name1-carbamoyl-3-pyridin-2-ylurea
PubChem CID564989
Molecular FormulaC7H8N4O2
Molecular Weight180.17 g/mol
Exact Mass180.06
IUPAC Name1-carbamoyl-3-pyridin-2-ylurea
SMILESNC(=O)NC(=O)Nc1ccccn1
InChIInChI=1S/C7H8N4O2/c8-6(12)11-7(13)10-5-3-1-2-4-9-5/h1-4H,(H4,8,9,10,11,12,13)
InChIKeyJZHDDPZVHRKTSN-UHFFFAOYSA-N
XLogP0.28
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.17
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxy-3-pyridin-2-ylurea
CID 20612761
1-(N'-propylcarbamimidoyl)-3-pyridin-2-ylurea
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CID 67884901
pyridin-2-ylthiourea
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N,N'-dipyridin-2-ylbutanediamide
CID 3684644
1-(3-aminopropyl)-3-pyridin-2-ylurea
CID 110492095
1-(4-chloro-2-pyridinyl)-3-pyridin-2-ylurea
CID 108894678
1-carbamoyl-3-[6-(carbamoylcarbamoylamino)-1,10-phenanthrolin-5-yl]urea
CID 101381275
1-(4-fluorophenyl)-3-pyridin-2-ylurea
CID 17267918
(2R)-2-(4-fluorophenyl)-2-(pyridin-2-ylcarbamoylamino)acetamide
CID 100749906
pyridine;N-pyridin-2-ylacetamide
CID 67298573
1-pyridin-2-yl-3-(pyridin-4-ylmethyl)urea
CID 47237582

Frequently Asked Questions

What is the IUPAC name of 1-carbamoyl-3-pyridin-2-ylurea?
The IUPAC name of 1-carbamoyl-3-pyridin-2-ylurea (CID 564989) is 1-carbamoyl-3-pyridin-2-ylurea.
What is the SMILES notation for 1-carbamoyl-3-pyridin-2-ylurea?
The canonical SMILES for 1-carbamoyl-3-pyridin-2-ylurea is NC(=O)NC(=O)Nc1ccccn1.
What is the InChIKey of 1-carbamoyl-3-pyridin-2-ylurea?
The InChIKey is JZHDDPZVHRKTSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O2/c8-6(12)11-7(13)10-5-3-1-2-4-9-5/h1-4H,(H4,8,9,10,11,12,13).
What are the key properties of 1-carbamoyl-3-pyridin-2-ylurea?
1-carbamoyl-3-pyridin-2-ylurea has a molecular weight of 180.17 g/mol, XLogP of 0.28, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbamoyl-3-pyridin-2-ylurea is sourced from PubChem (CID 564989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).