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

C12H20N4O — CID 80871543

IUPACN,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine
SMILESCNc1nc(C)cc(OCCN2CCCC2)n1
InChIInChI=1S/C12H20N4O/c1-10-9-11(15-12(13-2)14-10)17-8-7-16-5-3-4-6-16/h9H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyWDTPUDNNOMCPFM-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.30
Rot. Bonds5

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

N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine (PubChem CID 80871543) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine
PubChem CID80871543
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine
SMILESCNc1nc(C)cc(OCCN2CCCC2)n1
InChIInChI=1S/C12H20N4O/c1-10-9-11(15-12(13-2)14-10)17-8-7-16-5-3-4-6-16/h9H,3-8H2,1-2H3,(H,13,14,15)
InChIKeyWDTPUDNNOMCPFM-UHFFFAOYSA-N
XLogP1.30
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-6-propoxy-N-(3-pyrrolidin-1-ylpropyl)pyrimidin-2-amine
CID 115975022
4-[2-(dimethylamino)ethoxy]-N,6-dimethylpyrimidin-2-amine
CID 80870972
4-hexoxy-N,6-dimethylpyrimidin-2-amine
CID 80862000
4-(2-ethoxyethoxy)-N,6-dimethylpyrimidin-2-amine
CID 80858314
2-methyl-6-(2-piperidin-1-ylethoxy)pyridine-4-carbonitrile
CID 114766899
4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N,6-dimethylpyrimidin-2-amine
CID 104568171
N-methyl-2-propan-2-yl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
CID 80962688
N,4-dimethyl-6-(2-phenoxyethoxy)pyrimidin-2-amine
CID 80859312
N-ethyl-2-methyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
CID 80870434
[2-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine
CID 80920622
N-methyl-6-(2-pyrrolidin-1-ylethoxy)pyridin-2-amine
CID 80870610
4-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-6-propoxypyrimidin-2-amine
CID 115975019

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine?
The IUPAC name of N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine (CID 80871543) is N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine.
What is the SMILES notation for N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine?
The canonical SMILES for N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine is CNc1nc(C)cc(OCCN2CCCC2)n1.
What is the InChIKey of N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine?
The InChIKey is WDTPUDNNOMCPFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-10-9-11(15-12(13-2)14-10)17-8-7-16-5-3-4-6-16/h9H,3-8H2,1-2H3,(H,13,14,15).
What are the key properties of N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine?
N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine has a molecular weight of 236.32 g/mol, XLogP of 1.30, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-2-amine is sourced from PubChem (CID 80871543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).