2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide

C13H20N4O2 — CID 109360582

IUPAC2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)NC(C)C)cc(N2CCOCC2)n1
InChIInChI=1S/C13H20N4O2/c1-9(2)14-13(18)11-8-12(16-10(3)15-11)17-4-6-19-7-5-17/h8-9H,4-7H2,1-3H3,(H,14,18)
InChIKeyHQEZTKIMQMYXKJ-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.76
Rot. Bonds3

About 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide

2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide (PubChem CID 109360582) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide
PubChem CID109360582
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide
SMILESCc1nc(C(=O)NC(C)C)cc(N2CCOCC2)n1
InChIInChI=1S/C13H20N4O2/c1-9(2)14-13(18)11-8-12(16-10(3)15-11)17-4-6-19-7-5-17/h8-9H,4-7H2,1-3H3,(H,14,18)
InChIKeyHQEZTKIMQMYXKJ-UHFFFAOYSA-N
XLogP0.76
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-ethylpiperazin-1-yl)-2-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360588
6-morpholin-4-yl-2-phenyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 112851592
N-(2,6-dimethylphenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365418
2-methyl-6-morpholin-4-yl-N-phenylpyrimidine-4-carboxamide
CID 109365407
2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360632
6-(azepan-1-yl)-N-butan-2-yl-2-methylpyrimidine-4-carboxamide
CID 109362582
N-butyl-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109361747
N-(3,4-dichlorophenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365492
6-(4-benzylpiperazin-1-yl)-2-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360619
2-methyl-6-morpholin-4-yl-N-(2-morpholin-4-ylphenyl)pyrimidine-4-carboxamide
CID 109365473
6-morpholin-4-yl-N-propan-2-ylpyridazine-3-carboxamide
CID 109109608
N-(4-ethoxyphenyl)-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365450

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide?
The IUPAC name of 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide (CID 109360582) is 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide?
The canonical SMILES for 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide is Cc1nc(C(=O)NC(C)C)cc(N2CCOCC2)n1.
What is the InChIKey of 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide?
The InChIKey is HQEZTKIMQMYXKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-9(2)14-13(18)11-8-12(16-10(3)15-11)17-4-6-19-7-5-17/h8-9H,4-7H2,1-3H3,(H,14,18).
What are the key properties of 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide?
2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 109360582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).