N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine

C12H20N4 — CID 62192524

IUPACN-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine
SMILESCNc1cc(C(C)C)nc(N2CCCC2)n1
InChIInChI=1S/C12H20N4/c1-9(2)10-8-11(13-3)15-12(14-10)16-6-4-5-7-16/h8-9H,4-7H2,1-3H3,(H,13,14,15)
InChIKeyYDPDHRJJYOECLX-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.24
Rot. Bonds3

About N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine

N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine (PubChem CID 62192524) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine
PubChem CID62192524
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine
SMILESCNc1cc(C(C)C)nc(N2CCCC2)n1
InChIInChI=1S/C12H20N4/c1-9(2)10-8-11(13-3)15-12(14-10)16-6-4-5-7-16/h8-9H,4-7H2,1-3H3,(H,13,14,15)
InChIKeyYDPDHRJJYOECLX-UHFFFAOYSA-N
XLogP2.24
TPSA41.05 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 ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine?
The IUPAC name of N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine (CID 62192524) is N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine.
What is the SMILES notation for N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine?
The canonical SMILES for N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine is CNc1cc(C(C)C)nc(N2CCCC2)n1.
What is the InChIKey of N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine?
The InChIKey is YDPDHRJJYOECLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9(2)10-8-11(13-3)15-12(14-10)16-6-4-5-7-16/h8-9H,4-7H2,1-3H3,(H,13,14,15).
What are the key properties of N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine?
N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-propan-2-yl-2-pyrrolidin-1-ylpyrimidin-4-amine is sourced from PubChem (CID 62192524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).