N,N-dimethyl-4-phenylpyrimidin-2-amine

C12H13N3 — CID 10631842

IUPACN,N-dimethyl-4-phenylpyrimidin-2-amine
SMILESCN(C)c1nccc(-c2ccccc2)n1
InChIInChI=1S/C12H13N3/c1-15(2)12-13-9-8-11(14-12)10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKeyMFXXVOPBBBUOFX-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.21
Rot. Bonds2

About N,N-dimethyl-4-phenylpyrimidin-2-amine

N,N-dimethyl-4-phenylpyrimidin-2-amine (PubChem CID 10631842) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is N,N-dimethyl-4-phenylpyrimidin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-phenylpyrimidin-2-amine
PubChem CID10631842
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC NameN,N-dimethyl-4-phenylpyrimidin-2-amine
SMILESCN(C)c1nccc(-c2ccccc2)n1
InChIInChI=1S/C12H13N3/c1-15(2)12-13-9-8-11(14-12)10-6-4-3-5-7-10/h3-9H,1-2H3
InChIKeyMFXXVOPBBBUOFX-UHFFFAOYSA-N
XLogP2.21
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-phenylpyrimidin-2-amine?
The IUPAC name of N,N-dimethyl-4-phenylpyrimidin-2-amine (CID 10631842) is N,N-dimethyl-4-phenylpyrimidin-2-amine.
What is the SMILES notation for N,N-dimethyl-4-phenylpyrimidin-2-amine?
The canonical SMILES for N,N-dimethyl-4-phenylpyrimidin-2-amine is CN(C)c1nccc(-c2ccccc2)n1.
What is the InChIKey of N,N-dimethyl-4-phenylpyrimidin-2-amine?
The InChIKey is MFXXVOPBBBUOFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-15(2)12-13-9-8-11(14-12)10-6-4-3-5-7-10/h3-9H,1-2H3.
What are the key properties of N,N-dimethyl-4-phenylpyrimidin-2-amine?
N,N-dimethyl-4-phenylpyrimidin-2-amine has a molecular weight of 199.26 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-phenylpyrimidin-2-amine is sourced from PubChem (CID 10631842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).