N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide

C14H19N5O2 — CID 137049118

IUPACN,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide
SMILESCCCN(C)C(=O)c1cnn(-c2nc(C)cc(=O)[nH]2)c1C
InChIInChI=1S/C14H19N5O2/c1-5-6-18(4)13(21)11-8-15-19(10(11)3)14-16-9(2)7-12(20)17-14/h7-8H,5-6H2,1-4H3,(H,16,17,20)
InChIKeyZLJMGMHAULOKPN-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.05
Rot. Bonds4

About N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide

N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide (PubChem CID 137049118) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide
PubChem CID137049118
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC NameN,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide
SMILESCCCN(C)C(=O)c1cnn(-c2nc(C)cc(=O)[nH]2)c1C
InChIInChI=1S/C14H19N5O2/c1-5-6-18(4)13(21)11-8-15-19(10(11)3)14-16-9(2)7-12(20)17-14/h7-8H,5-6H2,1-4H3,(H,16,17,20)
InChIKeyZLJMGMHAULOKPN-UHFFFAOYSA-N
XLogP1.05
TPSA83.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[2-(7-azabicyclo[2.2.1]heptan-7-yl)acetyl]-5-methylpyrazol-1-yl]-4-methyl-1H-pyrimidin-6-one
CID 137128030
5-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-(pyrazin-2-ylmethyl)pyrazole-4-carboxamide
CID 137128031
4-methyl-2-[5-methyl-4-(2-methyl-2,3-dihydroindole-1-carbonyl)pyrazol-1-yl]-1H-pyrimidin-6-one
CID 137049037
N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-5-propan-2-ylpyrazole-4-carboxamide
CID 137049041
N-[2-(dimethylamino)ethyl]-N,5-dimethyl-1-propylpyrazole-4-carboxamide
CID 72881553
1-(4-fluorophenyl)-N-iodo-5-methyl-N-propylpyrazole-4-carboxamide
CID 142010489
N,2,3-trimethyl-5-oxo-N-propyl-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 126469973
N'-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]-N-prop-2-enyloxamide
CID 136641277
3-[[1-(3-bromophenyl)-5-methylpyrazole-4-carbonyl]-methylamino]propanoic acid
CID 119232427
N-(2-aminoethyl)-N,5,7-trimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55103751
N-(5-bromopentyl)-N,1,5-trimethylpyrazole-4-carboxamide
CID 107206006
N-(3-amino-2,2-dimethylpropyl)-1-(4-fluorophenyl)-N,5-dimethylpyrazole-4-carboxamide
CID 119653761

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide?
The IUPAC name of N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide (CID 137049118) is N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide.
What is the SMILES notation for N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide?
The canonical SMILES for N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide is CCCN(C)C(=O)c1cnn(-c2nc(C)cc(=O)[nH]2)c1C.
What is the InChIKey of N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide?
The InChIKey is ZLJMGMHAULOKPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-5-6-18(4)13(21)11-8-15-19(10(11)3)14-16-9(2)7-12(20)17-14/h7-8H,5-6H2,1-4H3,(H,16,17,20).
What are the key properties of N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide?
N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide has a molecular weight of 289.34 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-N-propylpyrazole-4-carboxamide is sourced from PubChem (CID 137049118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).