N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine

C9H11N5 — CID 53015226

IUPACN,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine
SMILESCN(C)c1cc(-n2cccn2)ncn1
InChIInChI=1S/C9H11N5/c1-13(2)8-6-9(11-7-10-8)14-5-3-4-12-14/h3-7H,1-2H3
InChIKeyVWDYPSREUIJLKO-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.73
Rot. Bonds2

About N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine

N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine (PubChem CID 53015226) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine
PubChem CID53015226
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC NameN,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine
SMILESCN(C)c1cc(-n2cccn2)ncn1
InChIInChI=1S/C9H11N5/c1-13(2)8-6-9(11-7-10-8)14-5-3-4-12-14/h3-7H,1-2H3
InChIKeyVWDYPSREUIJLKO-UHFFFAOYSA-N
XLogP0.73
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine?
The IUPAC name of N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine (CID 53015226) is N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine.
What is the SMILES notation for N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine?
The canonical SMILES for N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine is CN(C)c1cc(-n2cccn2)ncn1.
What is the InChIKey of N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine?
The InChIKey is VWDYPSREUIJLKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c1-13(2)8-6-9(11-7-10-8)14-5-3-4-12-14/h3-7H,1-2H3.
What are the key properties of N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine?
N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine has a molecular weight of 189.22 g/mol, XLogP of 0.73, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-pyrazol-1-ylpyrimidin-4-amine is sourced from PubChem (CID 53015226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).