2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide

C10H15N3O — CID 110847887

IUPAC2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC(C)C)nc(C)n1
InChIInChI=1S/C10H15N3O/c1-6(2)11-10(14)9-5-7(3)12-8(4)13-9/h5-6H,1-4H3,(H,11,14)
InChIKeyVKQJEHLIGSWUFA-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.23
Rot. Bonds2

About 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide

2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide (PubChem CID 110847887) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide
PubChem CID110847887
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NC(C)C)nc(C)n1
InChIInChI=1S/C10H15N3O/c1-6(2)11-10(14)9-5-7(3)12-8(4)13-9/h5-6H,1-4H3,(H,11,14)
InChIKeyVKQJEHLIGSWUFA-UHFFFAOYSA-N
XLogP1.23
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-N-propan-2-yl-2-(propan-2-ylamino)pyrimidine-4-carboxamide
CID 109319251
6-(2-methoxyethylamino)-2-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360580
propan-2-yl (2S)-3-[(2,6-dimethylpyrimidine-4-carbonyl)amino]-2-methylpropanoate
CID 97353365
2-(4-acetylpiperazin-1-yl)-6-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109319468
2-methyl-6-morpholin-4-yl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360582
2-(2,6-dichloroanilino)-6-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109319628
2,6-dimethyl-N-(2-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 110858050
N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2,6-dimethylpyrimidine-4-carboxamide
CID 131889440
6-(2-fluoroanilino)-2-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360683
2-methyl-N-propan-2-yl-6-(2-propan-2-ylanilino)pyrimidine-4-carboxamide
CID 109360676
2-[benzyl(methyl)amino]-6-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109319475
6-(4-ethylpiperazin-1-yl)-2-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109360588

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide?
The IUPAC name of 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide (CID 110847887) is 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide is Cc1cc(C(=O)NC(C)C)nc(C)n1.
What is the InChIKey of 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide?
The InChIKey is VKQJEHLIGSWUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-6(2)11-10(14)9-5-7(3)12-8(4)13-9/h5-6H,1-4H3,(H,11,14).
What are the key properties of 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide?
2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide has a molecular weight of 193.25 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-propan-2-ylpyrimidine-4-carboxamide is sourced from PubChem (CID 110847887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).