N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine

C14H24N4O — CID 80871549

IUPACN-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
SMILESCCNc1nc(C)nc(OCCN2CCCC2)c1C
InChIInChI=1S/C14H24N4O/c1-4-15-13-11(2)14(17-12(3)16-13)19-10-9-18-7-5-6-8-18/h4-10H2,1-3H3,(H,15,16,17)
InChIKeyVOXYXCOFCNQZEQ-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.00
Rot. Bonds6

About N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine

N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine (PubChem CID 80871549) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
PubChem CID80871549
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
SMILESCCNc1nc(C)nc(OCCN2CCCC2)c1C
InChIInChI=1S/C14H24N4O/c1-4-15-13-11(2)14(17-12(3)16-13)19-10-9-18-7-5-6-8-18/h4-10H2,1-3H3,(H,15,16,17)
InChIKeyVOXYXCOFCNQZEQ-UHFFFAOYSA-N
XLogP2.00
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine?
The IUPAC name of N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine (CID 80871549) is N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine is CCNc1nc(C)nc(OCCN2CCCC2)c1C.
What is the InChIKey of N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine?
The InChIKey is VOXYXCOFCNQZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-15-13-11(2)14(17-12(3)16-13)19-10-9-18-7-5-6-8-18/h4-10H2,1-3H3,(H,15,16,17).
What are the key properties of N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine?
N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine is sourced from PubChem (CID 80871549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).