N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine

C13H19N5 — CID 114197828

IUPACN,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine
SMILESCNc1nc(C)nc(-c2ccnn2C(C)C)c1C
InChIInChI=1S/C13H19N5/c1-8(2)18-11(6-7-15-18)12-9(3)13(14-5)17-10(4)16-12/h6-8H,1-5H3,(H,14,16,17)
InChIKeyWUOQHBXNXRFVDX-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.58
Rot. Bonds3

About N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine

N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine (PubChem CID 114197828) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine
PubChem CID114197828
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC NameN,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine
SMILESCNc1nc(C)nc(-c2ccnn2C(C)C)c1C
InChIInChI=1S/C13H19N5/c1-8(2)18-11(6-7-15-18)12-9(3)13(14-5)17-10(4)16-12/h6-8H,1-5H3,(H,14,16,17)
InChIKeyWUOQHBXNXRFVDX-UHFFFAOYSA-N
XLogP2.58
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine
CID 114197836
4-N-methyl-6-(2-propan-2-ylpyrazol-3-yl)-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 69095779
5-methoxy-N-methyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine
CID 114197839
N,2,5-trimethyl-6-(2,4,5-trifluorophenyl)pyrimidin-4-amine
CID 115503288
N,5-dimethyl-2-propyl-6-(2-propylpyrazol-3-yl)pyrimidin-4-amine
CID 80976645
6-(3-methoxypyrazin-2-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 104516628
N,2,5-trimethyl-6-(5-methyl-1-benzofuran-2-yl)pyrimidin-4-amine
CID 114734511
6-(3-fluoro-4-methylphenyl)-N,2,5-trimethylpyrimidin-4-amine
CID 113324439
6-N,2,5-trimethyl-4-N-(1-pyrazol-1-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80809420
6-N,2,5-trimethyl-4-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrimidine-4,6-diamine
CID 103012590
2-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-6-(2-propan-2-ylpyrazol-3-yl)pyrimidine
CID 125012000
2-methyl-4-(2-propan-2-ylpyrazol-3-yl)-6-[(3R)-1-propan-2-ylpyrrolidin-3-yl]pyrimidine
CID 124989938

Frequently Asked Questions

What is the IUPAC name of N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine?
The IUPAC name of N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine (CID 114197828) is N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine.
What is the SMILES notation for N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine?
The canonical SMILES for N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine is CNc1nc(C)nc(-c2ccnn2C(C)C)c1C.
What is the InChIKey of N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine?
The InChIKey is WUOQHBXNXRFVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-8(2)18-11(6-7-15-18)12-9(3)13(14-5)17-10(4)16-12/h6-8H,1-5H3,(H,14,16,17).
What are the key properties of N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine?
N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine has a molecular weight of 245.33 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,5-trimethyl-6-(2-propan-2-ylpyrazol-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 114197828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).