N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide

C13H22N4O2 — CID 109364679

IUPACN,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide
SMILESCCN(CC)C(=O)c1cc(NCCOC)nc(C)n1
InChIInChI=1S/C13H22N4O2/c1-5-17(6-2)13(18)11-9-12(14-7-8-19-4)16-10(3)15-11/h9H,5-8H2,1-4H3,(H,14,15,16)
InChIKeyDMWDCJMRKISLGV-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.33
Rot. Bonds7

About N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide

N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide (PubChem CID 109364679) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide
PubChem CID109364679
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide
SMILESCCN(CC)C(=O)c1cc(NCCOC)nc(C)n1
InChIInChI=1S/C13H22N4O2/c1-5-17(6-2)13(18)11-9-12(14-7-8-19-4)16-10(3)15-11/h9H,5-8H2,1-4H3,(H,14,15,16)
InChIKeyDMWDCJMRKISLGV-UHFFFAOYSA-N
XLogP1.33
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-(2-methoxyethylamino)-2-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360580
N-(2-methoxyethyl)-6-(3-methoxypropylamino)-2-methylpyrimidine-4-carboxamide
CID 109364804
N-[4-(diethylamino)phenyl]-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide
CID 109364760
6-(2-methoxyethylamino)-2-methyl-N-(3-methylbutyl)pyrimidine-4-carboxamide
CID 109364686
6-(2-methoxyethylamino)-2-methyl-N-[(4-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109364634
6-[2-(2,4-dichlorophenyl)ethylamino]-N,N-diethyl-2-methylpyrimidine-4-carboxamide
CID 109373410
6-[(4-chlorophenyl)methylamino]-N,N-diethyl-2-methylpyrimidine-4-carboxamide
CID 109370085
6-(2-methoxyethylamino)-2-methyl-N-[(2-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109364632
N-(2-ethylphenyl)-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide
CID 109364710
N-(3,4-dichlorophenyl)-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide
CID 109364786
6-(2-methoxyethylamino)-2-methyl-N-[(3-methylphenyl)methyl]pyrimidine-4-carboxamide
CID 109364633
N,N-diethyl-6-[2-(4-methoxyphenoxy)ethylamino]pyrimidine-4-carboxamide
CID 109353387

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide?
The IUPAC name of N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide (CID 109364679) is N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide.
What is the SMILES notation for N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide?
The canonical SMILES for N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide is CCN(CC)C(=O)c1cc(NCCOC)nc(C)n1.
What is the InChIKey of N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide?
The InChIKey is DMWDCJMRKISLGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-5-17(6-2)13(18)11-9-12(14-7-8-19-4)16-10(3)15-11/h9H,5-8H2,1-4H3,(H,14,15,16).
What are the key properties of N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide?
N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 1.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-6-(2-methoxyethylamino)-2-methylpyrimidine-4-carboxamide is sourced from PubChem (CID 109364679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).