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

C12H20N4 — CID 114794364

IUPAC4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine
SMILESCc1cc(C)nc(NCCC2CCCN2)n1
InChIInChI=1S/C12H20N4/c1-9-8-10(2)16-12(15-9)14-7-5-11-4-3-6-13-11/h8,11,13H,3-7H2,1-2H3,(H,14,15,16)
InChIKeyQGYDGODSJSBCIL-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.65
Rot. Bonds4

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

4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine (PubChem CID 114794364) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine
PubChem CID114794364
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine
SMILESCc1cc(C)nc(NCCC2CCCN2)n1
InChIInChI=1S/C12H20N4/c1-9-8-10(2)16-12(15-9)14-7-5-11-4-3-6-13-11/h8,11,13H,3-7H2,1-2H3,(H,14,15,16)
InChIKeyQGYDGODSJSBCIL-UHFFFAOYSA-N
XLogP1.65
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine;hydrochloride
CID 71638393
3,6-dimethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973149
5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 104973121
4,6-dimethyl-2-(3-pyrrolidin-2-ylpropylsulfanyl)pyrimidine
CID 62480857
5-methoxy-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrimidin-2-amine
CID 104973513
4-chloro-6-methyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 71638479
5-methoxy-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-2-amine
CID 104973111
N-(2-piperidin-2-ylethyl)-5-propan-2-ylpyrimidin-2-amine
CID 116975975
6-methoxy-2-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidin-4-amine
CID 104973053
4,6-dimethyl-2-(2-piperidin-2-ylethylsulfanyl)pyrimidine;hydrochloride
CID 72716590
5-nitro-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine
CID 114794411
4-propoxy-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine
CID 114794433

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine?
The IUPAC name of 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine (CID 114794364) is 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine?
The canonical SMILES for 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine is Cc1cc(C)nc(NCCC2CCCN2)n1.
What is the InChIKey of 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine?
The InChIKey is QGYDGODSJSBCIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9-8-10(2)16-12(15-9)14-7-5-11-4-3-6-13-11/h8,11,13H,3-7H2,1-2H3,(H,14,15,16).
What are the key properties of 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine?
4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-(2-pyrrolidin-2-ylethyl)pyrimidin-2-amine is sourced from PubChem (CID 114794364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).