4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide

C14H23N5O2 — CID 83105500

IUPAC4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide
SMILESCCNc1cc(C)nc(CN2CCOCC2C(=O)NC)n1
InChIInChI=1S/C14H23N5O2/c1-4-16-12-7-10(2)17-13(18-12)8-19-5-6-21-9-11(19)14(20)15-3/h7,11H,4-6,8-9H2,1-3H3,(H,15,20)(H,16,17,18)
InChIKeyAIRCWQPEHRDASI-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.16
Rot. Bonds5

About 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide

4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide (PubChem CID 83105500) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide
PubChem CID83105500
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC Name4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide
SMILESCCNc1cc(C)nc(CN2CCOCC2C(=O)NC)n1
InChIInChI=1S/C14H23N5O2/c1-4-16-12-7-10(2)17-13(18-12)8-19-5-6-21-9-11(19)14(20)15-3/h7,11H,4-6,8-9H2,1-3H3,(H,15,20)(H,16,17,18)
InChIKeyAIRCWQPEHRDASI-UHFFFAOYSA-N
XLogP0.16
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-6-methyl-2-[(3-methylmorpholin-4-yl)methyl]pyrimidin-4-amine
CID 80657828
4-[(4-amino-6-methylpyrimidin-2-yl)methyl]-N-ethylmorpholine-3-carboxamide
CID 83103789
methyl 1-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]pyrrolidine-2-carboxylate
CID 80657147
6-methyl-2-[(3-methylmorpholin-4-yl)methyl]-N-propylpyrimidin-4-amine
CID 80657743
(3S)-4-ethyl-N-methylmorpholine-3-carboxamide
CID 99978843
4-[(6-chloropyridazin-3-yl)methyl]-N-methylmorpholine-3-carboxamide
CID 104513820
4-[(2-amino-4-pyridinyl)methyl]-N-methylmorpholine-3-carboxamide
CID 83103647
4-[(4-chlorothieno[2,3-d]pyrimidin-2-yl)methyl]-N-methylmorpholine-3-carboxamide
CID 83098819
2-[(3,3-dimethylmorpholin-4-yl)methyl]-N-ethyl-6-methylpyrimidin-4-amine
CID 80657269
4-[(2-aminopyrimidin-4-yl)methyl]-N-methylmorpholine-3-carboxamide
CID 112751291
5-methyl-4-[[3-(methylcarbamoyl)morpholin-4-yl]methyl]thiophene-2-carboxylic acid
CID 83102863
N-ethyl-4-[[6-(ethylamino)-3-pyridinyl]methyl]morpholine-3-carboxamide
CID 83105484

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide?
The IUPAC name of 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide (CID 83105500) is 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide?
The canonical SMILES for 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide is CCNc1cc(C)nc(CN2CCOCC2C(=O)NC)n1.
What is the InChIKey of 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide?
The InChIKey is AIRCWQPEHRDASI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-4-16-12-7-10(2)17-13(18-12)8-19-5-6-21-9-11(19)14(20)15-3/h7,11H,4-6,8-9H2,1-3H3,(H,15,20)(H,16,17,18).
What are the key properties of 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide?
4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]-N-methylmorpholine-3-carboxamide is sourced from PubChem (CID 83105500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).