6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine

C16H21N5O2 — CID 110112420

IUPAC6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
SMILESCNc1cccc(C2CN(Cc3cnc(OC)nc3)CCO2)n1
InChIInChI=1S/C16H21N5O2/c1-17-15-5-3-4-13(20-15)14-11-21(6-7-23-14)10-12-8-18-16(22-2)19-9-12/h3-5,8-9,14H,6-7,10-11H2,1-2H3,(H,17,20)
InChIKeyPIZQCDRURABWLE-UHFFFAOYSA-N
MW315.38 g/mol
LogP1.50
Rot. Bonds5

About 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine

6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine (PubChem CID 110112420) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
PubChem CID110112420
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC Name6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine
SMILESCNc1cccc(C2CN(Cc3cnc(OC)nc3)CCO2)n1
InChIInChI=1S/C16H21N5O2/c1-17-15-5-3-4-13(20-15)14-11-21(6-7-23-14)10-12-8-18-16(22-2)19-9-12/h3-5,8-9,14H,6-7,10-11H2,1-2H3,(H,17,20)
InChIKeyPIZQCDRURABWLE-UHFFFAOYSA-N
XLogP1.50
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine (CID 110112420) is 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine is CNc1cccc(C2CN(Cc3cnc(OC)nc3)CCO2)n1.
What is the InChIKey of 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
The InChIKey is PIZQCDRURABWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-17-15-5-3-4-13(20-15)14-11-21(6-7-23-14)10-12-8-18-16(22-2)19-9-12/h3-5,8-9,14H,6-7,10-11H2,1-2H3,(H,17,20).
What are the key properties of 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine?
6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine has a molecular weight of 315.38 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[(2-methoxypyrimidin-5-yl)methyl]morpholin-2-yl]-N-methylpyridin-2-amine is sourced from PubChem (CID 110112420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).