N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine

C19H26N6O — CID 175649260

IUPACN-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
SMILESCc1cccc(N2CCCC(Nc3ccnc(N4CCOCC4)n3)C2)n1
InChIInChI=1S/C19H26N6O/c1-15-4-2-6-18(21-15)25-9-3-5-16(14-25)22-17-7-8-20-19(23-17)24-10-12-26-13-11-24/h2,4,6-8,16H,3,5,9-14H2,1H3,(H,20,22,23)
InChIKeyWSBFVFFGWLZZET-UHFFFAOYSA-N
MW354.46 g/mol
LogP2.10
Rot. Bonds4

About N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine

N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine (PubChem CID 175649260) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
PubChem CID175649260
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC NameN-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
SMILESCc1cccc(N2CCCC(Nc3ccnc(N4CCOCC4)n3)C2)n1
InChIInChI=1S/C19H26N6O/c1-15-4-2-6-18(21-15)25-9-3-5-16(14-25)22-17-7-8-20-19(23-17)24-10-12-26-13-11-24/h2,4,6-8,16H,3,5,9-14H2,1H3,(H,20,22,23)
InChIKeyWSBFVFFGWLZZET-UHFFFAOYSA-N
XLogP2.10
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine?
The IUPAC name of N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine (CID 175649260) is N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine is Cc1cccc(N2CCCC(Nc3ccnc(N4CCOCC4)n3)C2)n1.
What is the InChIKey of N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine?
The InChIKey is WSBFVFFGWLZZET-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O/c1-15-4-2-6-18(21-15)25-9-3-5-16(14-25)22-17-7-8-20-19(23-17)24-10-12-26-13-11-24/h2,4,6-8,16H,3,5,9-14H2,1H3,(H,20,22,23).
What are the key properties of N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine?
N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine has a molecular weight of 354.46 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 175649260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).