2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine

C17H11N3OS — CID 141073692

IUPAC2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine
SMILESc1ccc(-c2csc(-c3ccco3)c2-c2ncccn2)nc1
InChIInChI=1S/C17H11N3OS/c1-2-7-18-13(5-1)12-11-22-16(14-6-3-10-21-14)15(12)17-19-8-4-9-20-17/h1-11H
InChIKeyGCYBEIUBTDYERP-UHFFFAOYSA-N
MW305.36 g/mol
LogP4.53
Rot. Bonds3

About 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine

2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine (PubChem CID 141073692) has the molecular formula C17H11N3OS and a molecular weight of 305.36 g/mol. Its IUPAC name is 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine.

Molecular Properties

Compound Name2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine
PubChem CID141073692
Molecular FormulaC17H11N3OS
Molecular Weight305.36 g/mol
Exact Mass305.06
IUPAC Name2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine
SMILESc1ccc(-c2csc(-c3ccco3)c2-c2ncccn2)nc1
InChIInChI=1S/C17H11N3OS/c1-2-7-18-13(5-1)12-11-22-16(14-6-3-10-21-14)15(12)17-19-8-4-9-20-17/h1-11H
InChIKeyGCYBEIUBTDYERP-UHFFFAOYSA-N
XLogP4.53
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-Ethyl-4-(furan-3-yl)thieno[3,2-d]pyrimidine
CID 44449709
4-(2-Furyl)-2-(4-pyridinyl)pyrimidine
CID 1485448
4-(1-Benzothiophen-2-yl)-6-(furan-2-yl)-2-(4-methylpiperazin-1-yl)pyrimidine
CID 10785771
4-(furan-3-yl)-N,N-dimethylthieno[3,2-d]pyrimidin-2-amine
CID 44449634
4-(1-Benzothiophen-2-yl)-6-(furan-3-yl)-2-(4-methylpiperazin-1-yl)pyrimidine
CID 10809550
6-(furan-2-yl)-N-(thiophen-2-ylmethyl)quinazolin-4-amine
CID 44223933
6-(furan-2-yl)-N-[(4-methylthiophen-2-yl)methyl]quinazolin-4-amine
CID 44223940
4-Furan-3-yl-2-(4-methyl-piperazin-1-yl)-6-thiophen-2-yl-pyrimidine
CID 44289462
2-(Furan-2-yl)-10-thia-5,7,12-triazatetracyclo[11.7.0.03,11.04,9]icosa-1(13),2,4(9),5,7,11-hexaen-8-amine
CID 46884360
4-[3-(Furan-3-yl)pyrrolo[3,2-c]pyridin-1-yl]pyrimidin-2-amine
CID 71580834
5-(furan-2-yl)-N-methyl-3-(thiophen-2-yl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine
CID 135423770
N-methyl-6-(2-methylfuran-3-yl)-N-[(3-methylthiophen-2-yl)methyl]quinazolin-4-amine
CID 44968220

Frequently Asked Questions

What is the IUPAC name of 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine?
The IUPAC name of 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine (CID 141073692) is 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine.
What is the SMILES notation for 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine?
The canonical SMILES for 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine is c1ccc(-c2csc(-c3ccco3)c2-c2ncccn2)nc1.
What is the InChIKey of 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine?
The InChIKey is GCYBEIUBTDYERP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3OS/c1-2-7-18-13(5-1)12-11-22-16(14-6-3-10-21-14)15(12)17-19-8-4-9-20-17/h1-11H.
What are the key properties of 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine?
2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine has a molecular weight of 305.36 g/mol, XLogP of 4.53, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(furan-2-yl)-4-pyridin-2-ylthiophen-3-yl]pyrimidine is sourced from PubChem (CID 141073692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).