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

C19H26N4O — CID 112912293

IUPACN-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(N(Cc2ccccc2)C(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C19H26N4O/c1-15(2)23(14-17-7-5-4-6-8-17)18-13-16(3)20-19(21-18)22-9-11-24-12-10-22/h4-8,13,15H,9-12,14H2,1-3H3
InChIKeyFGIDKJOUTUAMKG-UHFFFAOYSA-N
MW326.44 g/mol
LogP3.04
Rot. Bonds5

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

N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine (PubChem CID 112912293) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine
PubChem CID112912293
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC NameN-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(N(Cc2ccccc2)C(C)C)nc(N2CCOCC2)n1
InChIInChI=1S/C19H26N4O/c1-15(2)23(14-17-7-5-4-6-8-17)18-13-16(3)20-19(21-18)22-9-11-24-12-10-22/h4-8,13,15H,9-12,14H2,1-3H3
InChIKeyFGIDKJOUTUAMKG-UHFFFAOYSA-N
XLogP3.04
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine (CID 112912293) is N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine is Cc1cc(N(Cc2ccccc2)C(C)C)nc(N2CCOCC2)n1.
What is the InChIKey of N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is FGIDKJOUTUAMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-15(2)23(14-17-7-5-4-6-8-17)18-13-16(3)20-19(21-18)22-9-11-24-12-10-22/h4-8,13,15H,9-12,14H2,1-3H3.
What are the key properties of N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine?
N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 326.44 g/mol, XLogP of 3.04, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-methyl-2-morpholin-4-yl-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 112912293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).