1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen

C15H15N5O — CID 142291817

IUPAC1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen
SMILESN#Cc1ccc(NC(=O)Nc2cccc3cncn23)cc1.[H][H].[H][H]
InChIInChI=1S/C15H11N5O.2H2/c16-8-11-4-6-12(7-5-11)18-15(21)19-14-3-1-2-13-9-17-10-20(13)14;;/h1-7,9-10H,(H2,18,19,21);2*1H
InChIKeyCYIGCHBABJCZNG-UHFFFAOYSA-N
MW281.32 g/mol
LogP3.34
Rot. Bonds2

About 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen

1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen (PubChem CID 142291817) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen.

Molecular Properties

Compound Name1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen
PubChem CID142291817
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen
SMILESN#Cc1ccc(NC(=O)Nc2cccc3cncn23)cc1.[H][H].[H][H]
InChIInChI=1S/C15H11N5O.2H2/c16-8-11-4-6-12(7-5-11)18-15(21)19-14-3-1-2-13-9-17-10-20(13)14;;/h1-7,9-10H,(H2,18,19,21);2*1H
InChIKeyCYIGCHBABJCZNG-UHFFFAOYSA-N
XLogP3.34
TPSA82.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-cyanophenyl)-3-[6-(4-fluorophenyl)imidazo[1,5-a]pyridin-5-yl]urea
CID 134298590
1-(4-cyanophenyl)-3-(1-phenylpyrazol-4-yl)urea
CID 47081496
N-[3-[(4-cyanophenyl)carbamoylamino]phenyl]acetamide
CID 108884114
1-(4-cyanophenyl)-3-(2,6-dimethylphenyl)urea
CID 3285930
1-[1-(2-chlorophenyl)pyrazol-4-yl]-3-(4-cyanophenyl)urea
CID 86895935
3-[(4-cyanophenyl)carbamoylamino]benzoic acid
CID 16786471
1-(4-cyanophenyl)-3-pyridin-2-ylurea
CID 108894633
1-(4-cyanophenyl)-3-(5H-imidazo[5,1-a]isoindol-5-ylmethyl)urea
CID 122504382
1-(4-cyanophenyl)-3-(4H-imidazo[1,5-a]indol-4-ylmethyl)urea
CID 122504288
1-(4-cyanophenyl)-3-(4-hydroxy-5-oxocyclohepta-1,3,6-trien-1-yl)urea
CID 16662014
N-(4-cyanophenyl)pyrrole-1-carboxamide
CID 57233702
1-(3-cyanophenyl)-3-pyridin-4-ylurea
CID 110706525

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen?
The IUPAC name of 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen (CID 142291817) is 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen.
What is the SMILES notation for 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen?
The canonical SMILES for 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen is N#Cc1ccc(NC(=O)Nc2cccc3cncn23)cc1.[H][H].[H][H].
What is the InChIKey of 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen?
The InChIKey is CYIGCHBABJCZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5O.2H2/c16-8-11-4-6-12(7-5-11)18-15(21)19-14-3-1-2-13-9-17-10-20(13)14;;/h1-7,9-10H,(H2,18,19,21);2*1H.
What are the key properties of 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen?
1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen has a molecular weight of 281.32 g/mol, XLogP of 3.34, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyanophenyl)-3-imidazo[1,5-a]pyridin-5-ylurea;molecular hydrogen is sourced from PubChem (CID 142291817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).