2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide

C13H18N6O — CID 28785555

IUPAC2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)N(C)CCCn2cccn2)nc(N)n1
InChIInChI=1S/C13H18N6O/c1-10-9-11(17-13(14)16-10)12(20)18(2)6-4-8-19-7-3-5-15-19/h3,5,7,9H,4,6,8H2,1-2H3,(H2,14,16,17)
InChIKeyRWMMPQGGVOUQAJ-UHFFFAOYSA-N
MW274.33 g/mol
LogP0.73
Rot. Bonds5

About 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide

2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide (PubChem CID 28785555) has the molecular formula C13H18N6O and a molecular weight of 274.33 g/mol. Its IUPAC name is 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide
PubChem CID28785555
Molecular FormulaC13H18N6O
Molecular Weight274.33 g/mol
Exact Mass274.15
IUPAC Name2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)N(C)CCCn2cccn2)nc(N)n1
InChIInChI=1S/C13H18N6O/c1-10-9-11(17-13(14)16-10)12(20)18(2)6-4-8-19-7-3-5-15-19/h3,5,7,9H,4,6,8H2,1-2H3,(H2,14,16,17)
InChIKeyRWMMPQGGVOUQAJ-UHFFFAOYSA-N
XLogP0.73
TPSA89.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1,5-dimethyl-1H-pyrazol-3-yl)[4-(2-pyrimidinyl)piperazino]methanone
CID 2738510
(1-Ethylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 6465535
(2-Methylpyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 4770296
(3,5-Dimethyl-4-(pyrimidin-2-ylthio)-1H-pyrazol-1-yl)(1-ethyl-3-methyl-1H-pyrazol-5-yl)methanone
CID 2745245
2-{4-[(4-chloro-1-methyl-1H-pyrazol-5-yl)carbonyl]-1-piperazinyl}pyrimidine
CID 4769678
2-imidazol-1-yl-N-pyridazin-4-yl-6-(trifluoromethyl)pyrimidine-4-carboxamide
CID 170774253
N-[(3S,4R)-4-[(dimethylamino)methyl]-1-(2-pyrimidinyl)tetrahydro-1H-pyrrol-3-yl]-1-methyl-1H-pyrazole-5-carboxamide
CID 91911067
5-methyl-N-(5-methyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl)-1-propan-2-ylpyrazole-3-carboxamide
CID 128647953
US10022354, Example 100
CID 121279607
N'-(1-tert-butyl-5-methylpyrazole-3-carbonyl)-1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidine-4-carbohydrazide
CID 2810214
(5-methyl-1H-pyrazol-3-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 20906482
N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-ethyl-5-methylpyrazole-3-carboxamide
CID 28099779

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide (CID 28785555) is 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide is Cc1cc(C(=O)N(C)CCCn2cccn2)nc(N)n1.
What is the InChIKey of 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide?
The InChIKey is RWMMPQGGVOUQAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O/c1-10-9-11(17-13(14)16-10)12(20)18(2)6-4-8-19-7-3-5-15-19/h3,5,7,9H,4,6,8H2,1-2H3,(H2,14,16,17).
What are the key properties of 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide?
2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide has a molecular weight of 274.33 g/mol, XLogP of 0.73, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,6-dimethyl-N-(3-pyrazol-1-ylpropyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 28785555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).