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

C10H12ClN3O — CID 87561240

IUPAC2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine
SMILESCCN(CC)c1nc(Cl)nc2ccoc12
InChIInChI=1S/C10H12ClN3O/c1-3-14(4-2)9-8-7(5-6-15-8)12-10(11)13-9/h5-6H,3-4H2,1-2H3
InChIKeyJHNVNUXQVBAWGL-UHFFFAOYSA-N
MW225.68 g/mol
LogP2.72
Rot. Bonds3

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

2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine (PubChem CID 87561240) has the molecular formula C10H12ClN3O and a molecular weight of 225.68 g/mol. Its IUPAC name is 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine
PubChem CID87561240
Molecular FormulaC10H12ClN3O
Molecular Weight225.68 g/mol
Exact Mass225.07
IUPAC Name2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine
SMILESCCN(CC)c1nc(Cl)nc2ccoc12
InChIInChI=1S/C10H12ClN3O/c1-3-14(4-2)9-8-7(5-6-15-8)12-10(11)13-9/h5-6H,3-4H2,1-2H3
InChIKeyJHNVNUXQVBAWGL-UHFFFAOYSA-N
XLogP2.72
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.68
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine?
The IUPAC name of 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine (CID 87561240) is 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine is CCN(CC)c1nc(Cl)nc2ccoc12.
What is the InChIKey of 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine?
The InChIKey is JHNVNUXQVBAWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3O/c1-3-14(4-2)9-8-7(5-6-15-8)12-10(11)13-9/h5-6H,3-4H2,1-2H3.
What are the key properties of 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine?
2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine has a molecular weight of 225.68 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N,N-diethylfuro[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 87561240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).