[1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine

C12H20N4 — CID 103279196

IUPAC[1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine
SMILESCCc1cnc(N2CCCC2CN)nc1C
InChIInChI=1S/C12H20N4/c1-3-10-8-14-12(15-9(10)2)16-6-4-5-11(16)7-13/h8,11H,3-7,13H2,1-2H3
InChIKeyOEBOVRYVHVBTGW-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.27
Rot. Bonds3

About [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine

[1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine (PubChem CID 103279196) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine
PubChem CID103279196
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name[1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine
SMILESCCc1cnc(N2CCCC2CN)nc1C
InChIInChI=1S/C12H20N4/c1-3-10-8-14-12(15-9(10)2)16-6-4-5-11(16)7-13/h8,11H,3-7,13H2,1-2H3
InChIKeyOEBOVRYVHVBTGW-UHFFFAOYSA-N
XLogP1.27
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(4-methyl-5-pentylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine
CID 103279282
[1-[5-(hydroxymethyl)-4-methylpyrimidin-2-yl]pyrrolidin-2-yl]methanol
CID 83184365
1-[2-(2-ethylpiperidin-1-yl)-4-methylpyrimidin-5-yl]-N-methylmethanamine
CID 83186290
[1-(5-tert-butylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine
CID 103279190
[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine
CID 16643268
[1-(5-fluoropyrimidin-2-yl)pyrrolidin-2-yl]methanamine
CID 71644678
N-[[2-(2-ethylpiperidin-1-yl)-4-methylpyrimidin-5-yl]methyl]-2-methylpropan-2-amine
CID 83178519
[1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine;hydrochloride
CID 71638307
[1-(5-nitropyrimidin-2-yl)pyrrolidin-2-yl]methanamine
CID 115313331
[1-(5,7-dihydrofuro[3,4-d]pyrimidin-2-yl)pyrrolidin-2-yl]methanamine
CID 83837791
[1-[4-(furan-2-yl)-5-methylpyrimidin-2-yl]pyrrolidin-2-yl]methanamine
CID 103279211
2-[1-(5-ethoxycarbonyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]acetic acid
CID 83180688

Frequently Asked Questions

What is the IUPAC name of [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine (CID 103279196) is [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine is CCc1cnc(N2CCCC2CN)nc1C.
What is the InChIKey of [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine?
The InChIKey is OEBOVRYVHVBTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-10-8-14-12(15-9(10)2)16-6-4-5-11(16)7-13/h8,11H,3-7,13H2,1-2H3.
What are the key properties of [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine?
[1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine has a molecular weight of 220.32 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-ethyl-4-methylpyrimidin-2-yl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 103279196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).