N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide

C9H7N3OS — CID 174849944

IUPACN-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide
SMILESO=CNc1cnc(-c2cccnc2)s1
InChIInChI=1S/C9H7N3OS/c13-6-12-8-5-11-9(14-8)7-2-1-3-10-4-7/h1-6H,(H,12,13)
InChIKeyUWGGFVQQSZGOOJ-UHFFFAOYSA-N
MW205.24 g/mol
LogP1.77
Rot. Bonds3

About N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide

N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide (PubChem CID 174849944) has the molecular formula C9H7N3OS and a molecular weight of 205.24 g/mol. Its IUPAC name is N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide.

Molecular Properties

Compound NameN-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide
PubChem CID174849944
Molecular FormulaC9H7N3OS
Molecular Weight205.24 g/mol
Exact Mass205.03
IUPAC NameN-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide
SMILESO=CNc1cnc(-c2cccnc2)s1
InChIInChI=1S/C9H7N3OS/c13-6-12-8-5-11-9(14-8)7-2-1-3-10-4-7/h1-6H,(H,12,13)
InChIKeyUWGGFVQQSZGOOJ-UHFFFAOYSA-N
XLogP1.77
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(2-pyridin-3-yl-1,3-thiazol-5-yl)acetaldehyde
CID 115091325
5-chloro-2-pyridin-3-yl-1,3-thiazole
CID 117259093
5-(bromomethyl)-2-pyridin-3-yl-1,3-thiazole
CID 82422643
2-(2-pyridin-3-yl-1,3-thiazol-5-yl)acetic acid
CID 82286214
5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole
CID 71226275
2-pyridin-3-yl-N-(pyrimidin-2-ylmethyl)-1,3-thiazole-5-carboxamide
CID 58236218
5-butyl-2-pyridin-3-yl-1,3-thiazole
CID 67548098
(5-pyridin-3-ylthiophen-2-yl) formate
CID 174545765
2-pyridin-3-yl-1,3-thiazole-5-carboximidamide
CID 82422642
4-(2-pyridin-3-yl-1,3-thiazol-5-yl)butan-1-amine
CID 11557701
2-[(E)-2-(2-pyridin-3-yl-1,3-thiazol-5-yl)ethenyl]-1,3-thiazole-5-carboxylic acid
CID 167875600
5-pyridin-3-yl-1,2,4-thiadiazole
CID 12600754

Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide?
The IUPAC name of N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide (CID 174849944) is N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide.
What is the SMILES notation for N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide?
The canonical SMILES for N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide is O=CNc1cnc(-c2cccnc2)s1.
What is the InChIKey of N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide?
The InChIKey is UWGGFVQQSZGOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3OS/c13-6-12-8-5-11-9(14-8)7-2-1-3-10-4-7/h1-6H,(H,12,13).
What are the key properties of N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide?
N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide has a molecular weight of 205.24 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-3-yl-1,3-thiazol-5-yl)formamide is sourced from PubChem (CID 174849944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).