N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine

C12H20N4O — CID 155565408

IUPACN-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)N(C)c1cc(N2CCOCC2)ncn1
InChIInChI=1S/C12H20N4O/c1-10(2)15(3)11-8-12(14-9-13-11)16-4-6-17-7-5-16/h8-10H,4-7H2,1-3H3
InChIKeyYXIYKFPXVUGSBF-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.16
Rot. Bonds3

About N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine

N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine (PubChem CID 155565408) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine
PubChem CID155565408
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)N(C)c1cc(N2CCOCC2)ncn1
InChIInChI=1S/C12H20N4O/c1-10(2)15(3)11-8-12(14-9-13-11)16-4-6-17-7-5-16/h8-10H,4-7H2,1-3H3
InChIKeyYXIYKFPXVUGSBF-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine (CID 155565408) is N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine is CC(C)N(C)c1cc(N2CCOCC2)ncn1.
What is the InChIKey of N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is YXIYKFPXVUGSBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-10(2)15(3)11-8-12(14-9-13-11)16-4-6-17-7-5-16/h8-10H,4-7H2,1-3H3.
What are the key properties of N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 236.32 g/mol, XLogP of 1.16, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 155565408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).