4-(dimethylamino)-2-methylpyrimidine-5-carboxamide

C8H12N4O — CID 23423588

IUPAC4-(dimethylamino)-2-methylpyrimidine-5-carboxamide
SMILESCc1ncc(C(N)=O)c(N(C)C)n1
InChIInChI=1S/C8H12N4O/c1-5-10-4-6(7(9)13)8(11-5)12(2)3/h4H,1-3H3,(H2,9,13)
InChIKeyFJGXRSVKOVABCX-UHFFFAOYSA-N
MW180.21 g/mol
LogP-0.05
Rot. Bonds2

About 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide

4-(dimethylamino)-2-methylpyrimidine-5-carboxamide (PubChem CID 23423588) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide.

Molecular Properties

Compound Name4-(dimethylamino)-2-methylpyrimidine-5-carboxamide
PubChem CID23423588
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name4-(dimethylamino)-2-methylpyrimidine-5-carboxamide
SMILESCc1ncc(C(N)=O)c(N(C)C)n1
InChIInChI=1S/C8H12N4O/c1-5-10-4-6(7(9)13)8(11-5)12(2)3/h4H,1-3H3,(H2,9,13)
InChIKeyFJGXRSVKOVABCX-UHFFFAOYSA-N
XLogP-0.05
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(dimethylamino)-2-methylpyrimidine-5-carbothioamide
CID 130541208
4-tert-butyl-2-methylpyrimidine-5-carboxamide
CID 89417187
4-(dimethylamino)-2-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide
CID 165397799
2-[4-(dimethylamino)-2-methylpyrimidin-5-yl]-N'-hydroxyethanimidamide
CID 83884463
N,N,2,4-tetramethylpyrimidine-5-carboxamide
CID 126992090
ethyl 2-methyl-4-[methyl(methylsulfonyl)amino]pyrimidine-5-carboxylate
CID 67099878
4-[cyclobutyl(methyl)amino]-2-methylpyrimidine-5-carboxylic acid
CID 115148774
2-(dimethylamino)-5-pyridin-4-ylpyridine-3-carboxamide
CID 20509458
2,4-dimethylpyrimidine-5-carboxylic acid
CID 6487595
4-[3,3-dimethylbutyl(methyl)amino]-2-methylpyrimidine-5-carboxylic acid
CID 115148828
2-methyl-4-(3-methylanilino)pyrimidine-5-carboxamide
CID 67477026
ethyl 4-(dimethylamino)-2-pyrrol-1-ylpyrimidine-5-carboxylate
CID 59517817

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide?
The IUPAC name of 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide (CID 23423588) is 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide.
What is the SMILES notation for 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide?
The canonical SMILES for 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide is Cc1ncc(C(N)=O)c(N(C)C)n1.
What is the InChIKey of 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide?
The InChIKey is FJGXRSVKOVABCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-5-10-4-6(7(9)13)8(11-5)12(2)3/h4H,1-3H3,(H2,9,13).
What are the key properties of 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide?
4-(dimethylamino)-2-methylpyrimidine-5-carboxamide has a molecular weight of 180.21 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-2-methylpyrimidine-5-carboxamide is sourced from PubChem (CID 23423588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).