N,N-dimethylpyrimidin-2-amine;1H-pyrazole

C9H13N5 — CID 174831012

IUPACN,N-dimethylpyrimidin-2-amine;1H-pyrazole
SMILESCN(C)c1ncccn1.c1cn[nH]c1
InChIInChI=1S/C6H9N3.C3H4N2/c1-9(2)6-7-4-3-5-8-6;1-2-4-5-3-1/h3-5H,1-2H3;1-3H,(H,4,5)
InChIKeyHQRPIHPEXZRGGP-UHFFFAOYSA-N
MW191.24 g/mol
LogP0.95
Rot. Bonds1

About N,N-dimethylpyrimidin-2-amine;1H-pyrazole

N,N-dimethylpyrimidin-2-amine;1H-pyrazole (PubChem CID 174831012) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is N,N-dimethylpyrimidin-2-amine;1H-pyrazole.

Molecular Properties

Compound NameN,N-dimethylpyrimidin-2-amine;1H-pyrazole
PubChem CID174831012
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC NameN,N-dimethylpyrimidin-2-amine;1H-pyrazole
SMILESCN(C)c1ncccn1.c1cn[nH]c1
InChIInChI=1S/C6H9N3.C3H4N2/c1-9(2)6-7-4-3-5-8-6;1-2-4-5-3-1/h3-5H,1-2H3;1-3H,(H,4,5)
InChIKeyHQRPIHPEXZRGGP-UHFFFAOYSA-N
XLogP0.95
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpyrimidin-2-amine;1H-pyrazole?
The IUPAC name of N,N-dimethylpyrimidin-2-amine;1H-pyrazole (CID 174831012) is N,N-dimethylpyrimidin-2-amine;1H-pyrazole.
What is the SMILES notation for N,N-dimethylpyrimidin-2-amine;1H-pyrazole?
The canonical SMILES for N,N-dimethylpyrimidin-2-amine;1H-pyrazole is CN(C)c1ncccn1.c1cn[nH]c1.
What is the InChIKey of N,N-dimethylpyrimidin-2-amine;1H-pyrazole?
The InChIKey is HQRPIHPEXZRGGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3.C3H4N2/c1-9(2)6-7-4-3-5-8-6;1-2-4-5-3-1/h3-5H,1-2H3;1-3H,(H,4,5).
What are the key properties of N,N-dimethylpyrimidin-2-amine;1H-pyrazole?
N,N-dimethylpyrimidin-2-amine;1H-pyrazole has a molecular weight of 191.24 g/mol, XLogP of 0.95, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpyrimidin-2-amine;1H-pyrazole is sourced from PubChem (CID 174831012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).