5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine

C14H11ClN4O2 — CID 18507689

IUPAC5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine
SMILESNc1nc(OCc2ccccn2)c(Cl)c(-c2ccco2)n1
InChIInChI=1S/C14H11ClN4O2/c15-11-12(10-5-3-7-20-10)18-14(16)19-13(11)21-8-9-4-1-2-6-17-9/h1-7H,8H2,(H2,16,18,19)
InChIKeyCSITZLITYIKOCG-UHFFFAOYSA-N
MW302.72 g/mol
LogP2.95
Rot. Bonds4

About 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine

5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine (PubChem CID 18507689) has the molecular formula C14H11ClN4O2 and a molecular weight of 302.72 g/mol. Its IUPAC name is 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine
PubChem CID18507689
Molecular FormulaC14H11ClN4O2
Molecular Weight302.72 g/mol
Exact Mass302.06
IUPAC Name5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine
SMILESNc1nc(OCc2ccccn2)c(Cl)c(-c2ccco2)n1
InChIInChI=1S/C14H11ClN4O2/c15-11-12(10-5-3-7-20-10)18-14(16)19-13(11)21-8-9-4-1-2-6-17-9/h1-7H,8H2,(H2,16,18,19)
InChIKeyCSITZLITYIKOCG-UHFFFAOYSA-N
XLogP2.95
TPSA87.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.72
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-4-(furan-2-yl)-6-phenylmethoxypyrimidin-2-amine
CID 18507653
6-(furan-2-yl)-9-(pyridin-2-ylmethyl)purin-2-amine
CID 59835056
2-amino-4-(furan-2-yl)-6-[2-(pyridin-2-ylmethyl)pyrrol-2-yl]pyrimidine-5-carbonitrile
CID 90746040
5-bromo-4,6-bis(furan-2-yl)pyrimidin-2-amine
CID 23020456
2-amino-4-(furan-2-yl)-6-(3-phenylprop-2-enoxy)pyrimidine-5-carbonitrile
CID 69289830
4-(furan-2-yl)-5-pyridin-2-yl-1,3-thiazol-2-amine
CID 23144699
4-(furan-2-yl)-5-phenylpyrimidin-2-amine
CID 134140522
2-(pyridin-4-yloxymethyl)pyridine
CID 58505689
9-[(1-benzylimidazol-2-yl)methyl]-6-(furan-2-yl)purin-2-amine
CID 58758787
2-[6-amino-4-(furan-2-yl)pyrazolo[3,4-d]pyrimidin-1-yl]-N-pyridin-2-ylacetamide
CID 23546893
[4-chloro-2-(pyridin-2-ylmethoxy)phenyl]methanamine
CID 113277219
4-(furan-2-yl)-N-(pyridin-2-ylmethyl)thieno[3,2-d]pyrimidin-2-amine
CID 59732402

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine?
The IUPAC name of 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine (CID 18507689) is 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine.
What is the SMILES notation for 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine?
The canonical SMILES for 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine is Nc1nc(OCc2ccccn2)c(Cl)c(-c2ccco2)n1.
What is the InChIKey of 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine?
The InChIKey is CSITZLITYIKOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN4O2/c15-11-12(10-5-3-7-20-10)18-14(16)19-13(11)21-8-9-4-1-2-6-17-9/h1-7H,8H2,(H2,16,18,19).
What are the key properties of 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine?
5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine has a molecular weight of 302.72 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(furan-2-yl)-6-(pyridin-2-ylmethoxy)pyrimidin-2-amine is sourced from PubChem (CID 18507689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).