2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine

C10H10ClN3O — CID 87562610

IUPAC2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine
SMILESClc1nc(NC2CCC2)c2occc2n1
InChIInChI=1S/C10H10ClN3O/c11-10-13-7-4-5-15-8(7)9(14-10)12-6-2-1-3-6/h4-6H,1-3H2,(H,12,13,14)
InChIKeyHJTVZCPQWDVXEF-UHFFFAOYSA-N
MW223.66 g/mol
LogP2.84
Rot. Bonds2

About 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine

2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine (PubChem CID 87562610) has the molecular formula C10H10ClN3O and a molecular weight of 223.66 g/mol. Its IUPAC name is 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine
PubChem CID87562610
Molecular FormulaC10H10ClN3O
Molecular Weight223.66 g/mol
Exact Mass223.05
IUPAC Name2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine
SMILESClc1nc(NC2CCC2)c2occc2n1
InChIInChI=1S/C10H10ClN3O/c11-10-13-7-4-5-15-8(7)9(14-10)12-6-2-1-3-6/h4-6H,1-3H2,(H,12,13,14)
InChIKeyHJTVZCPQWDVXEF-UHFFFAOYSA-N
XLogP2.84
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine?
The IUPAC name of 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine (CID 87562610) is 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine is Clc1nc(NC2CCC2)c2occc2n1.
What is the InChIKey of 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine?
The InChIKey is HJTVZCPQWDVXEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O/c11-10-13-7-4-5-15-8(7)9(14-10)12-6-2-1-3-6/h4-6H,1-3H2,(H,12,13,14).
What are the key properties of 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine?
2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine has a molecular weight of 223.66 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclobutylfuro[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 87562610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).