6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide

C13H14N4O2 — CID 91816304

IUPAC6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide
SMILESCCOc1cc(C(=O)Nc2ccc(C)cn2)ncn1
InChIInChI=1S/C13H14N4O2/c1-3-19-12-6-10(15-8-16-12)13(18)17-11-5-4-9(2)7-14-11/h4-8H,3H2,1-2H3,(H,14,17,18)
InChIKeyVYZYLGNSLVOHOZ-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.83
Rot. Bonds4

About 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide

6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide (PubChem CID 91816304) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide
PubChem CID91816304
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide
SMILESCCOc1cc(C(=O)Nc2ccc(C)cn2)ncn1
InChIInChI=1S/C13H14N4O2/c1-3-19-12-6-10(15-8-16-12)13(18)17-11-5-4-9(2)7-14-11/h4-8H,3H2,1-2H3,(H,14,17,18)
InChIKeyVYZYLGNSLVOHOZ-UHFFFAOYSA-N
XLogP1.83
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethoxy-N-(4-methylphenyl)pyrimidine-4-carboxamide
CID 121167580
N-(2-bromo-4-methylphenyl)-6-ethoxypyrimidine-4-carboxamide
CID 91816313
ethyl 2-[(6-ethoxypyrimidine-4-carbonyl)amino]benzoate
CID 121167557
N-(2-bromophenyl)-6-ethoxypyrimidine-4-carboxamide
CID 121167671
6-ethoxy-N-(2-fluorophenyl)pyrimidine-4-carboxamide
CID 91816253
6-ethoxy-N-(2,3,4-trifluorophenyl)pyrimidine-4-carboxamide
CID 121167635
N-(2,3-dichlorophenyl)-6-ethoxypyrimidine-4-carboxamide
CID 121167627
6-ethoxy-N-propylpyrimidine-4-carboxamide
CID 121167565
6-hydrazinyl-N-(5-methyl-2-pyridinyl)pyridazine-3-carboxamide
CID 62235642
ethyl 2-[(6-methoxypyrimidine-4-carbonyl)amino]benzoate
CID 121167291
3,5-dichloro-N-(5-methyl-2-pyridinyl)benzamide
CID 5063171
3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide
CID 103907650

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide?
The IUPAC name of 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide (CID 91816304) is 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide?
The canonical SMILES for 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide is CCOc1cc(C(=O)Nc2ccc(C)cn2)ncn1.
What is the InChIKey of 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide?
The InChIKey is VYZYLGNSLVOHOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-3-19-12-6-10(15-8-16-12)13(18)17-11-5-4-9(2)7-14-11/h4-8H,3H2,1-2H3,(H,14,17,18).
What are the key properties of 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide?
6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-(5-methyl-2-pyridinyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 91816304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).