N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide

C14H20N4O2 — CID 71807461

IUPACN-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide
SMILESCc1cc(N2CCOCC2)nc(CNC(=O)C2CC2)n1
InChIInChI=1S/C14H20N4O2/c1-10-8-13(18-4-6-20-7-5-18)17-12(16-10)9-15-14(19)11-2-3-11/h8,11H,2-7,9H2,1H3,(H,15,19)
InChIKeyXEUULNSFHLWFQF-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.65
Rot. Bonds4

About N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide

N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide (PubChem CID 71807461) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide
PubChem CID71807461
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide
SMILESCc1cc(N2CCOCC2)nc(CNC(=O)C2CC2)n1
InChIInChI=1S/C14H20N4O2/c1-10-8-13(18-4-6-20-7-5-18)17-12(16-10)9-15-14(19)11-2-3-11/h8,11H,2-7,9H2,1H3,(H,15,19)
InChIKeyXEUULNSFHLWFQF-UHFFFAOYSA-N
XLogP0.65
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide (CID 71807461) is N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide is Cc1cc(N2CCOCC2)nc(CNC(=O)C2CC2)n1.
What is the InChIKey of N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide?
The InChIKey is XEUULNSFHLWFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-10-8-13(18-4-6-20-7-5-18)17-12(16-10)9-15-14(19)11-2-3-11/h8,11H,2-7,9H2,1H3,(H,15,19).
What are the key properties of N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide?
N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide has a molecular weight of 276.34 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 71807461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).