6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine

C12H20N4 — CID 80563627

IUPAC6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
SMILESCCc1cc(NCC2CCNC2)nc(C)n1
InChIInChI=1S/C12H20N4/c1-3-11-6-12(16-9(2)15-11)14-8-10-4-5-13-7-10/h6,10,13H,3-5,7-8H2,1-2H3,(H,14,15,16)
InChIKeyCNPCYIALXPXBNM-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.37
Rot. Bonds4

About 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine

6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine (PubChem CID 80563627) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
PubChem CID80563627
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
SMILESCCc1cc(NCC2CCNC2)nc(C)n1
InChIInChI=1S/C12H20N4/c1-3-11-6-12(16-9(2)15-11)14-8-10-4-5-13-7-10/h6,10,13H,3-5,7-8H2,1-2H3,(H,14,15,16)
InChIKeyCNPCYIALXPXBNM-UHFFFAOYSA-N
XLogP1.37
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 ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dimethyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
CID 80563958
6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
CID 94076559
4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106130133
2-methyl-N-(piperidin-3-ylmethyl)-6-propan-2-ylpyrimidin-4-amine
CID 110277770
2-methyl-N-(piperidin-4-ylmethyl)-6-propan-2-ylpyrimidin-4-amine
CID 94076556
2-chloro-6-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
CID 71638561
6-ethyl-2-methyl-N-[(2-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 107419264
N,6-diethyl-2-methylpyrimidin-4-amine
CID 62191281
1-[4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]-2,2,2-trifluoroethanone
CID 133472278
6-ethyl-2-(2-fluorophenyl)-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
CID 56768131
6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 96586619
6-ethyl-N-[(1-ethylpiperidin-2-yl)methyl]-2-methylpyrimidin-4-amine
CID 133460649

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine (CID 80563627) is 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine is CCc1cc(NCC2CCNC2)nc(C)n1.
What is the InChIKey of 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine?
The InChIKey is CNPCYIALXPXBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-11-6-12(16-9(2)15-11)14-8-10-4-5-13-7-10/h6,10,13H,3-5,7-8H2,1-2H3,(H,14,15,16).
What are the key properties of 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine?
6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 80563627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).