2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile

C10H14N4 — CID 130284263

IUPAC2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile
SMILESCN(C)c1cc(C(C)(C)C#N)ncn1
InChIInChI=1S/C10H14N4/c1-10(2,6-11)8-5-9(14(3)4)13-7-12-8/h5,7H,1-4H3
InChIKeyLXLBSSUDDVISGP-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.34
Rot. Bonds2

About 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile

2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile (PubChem CID 130284263) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile.

Molecular Properties

Compound Name2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile
PubChem CID130284263
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile
SMILESCN(C)c1cc(C(C)(C)C#N)ncn1
InChIInChI=1S/C10H14N4/c1-10(2,6-11)8-5-9(14(3)4)13-7-12-8/h5,7H,1-4H3
InChIKeyLXLBSSUDDVISGP-UHFFFAOYSA-N
XLogP1.34
TPSA52.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[6-(dimethylamino)pyrimidin-4-yl]propanenitrile
CID 82410803
2-methyl-2-pyrimidin-4-ylpropanenitrile
CID 130544390
6-[tert-butyl(methyl)amino]pyrimidine-4-carbonitrile
CID 115142786
4-N,4-N-diethyl-6-N,6-N-dimethylpyrimidine-4,6-diamine
CID 22613295
N-ethyl-N-methyl-6-(2-methylpentan-2-yl)pyrimidin-4-amine
CID 134483265
N-[2-[(6-tert-butylpyrimidin-4-yl)-methylamino]ethyl]-N-methylmethanesulfonamide
CID 118581487
2-[(6-tert-butylpyrimidin-4-yl)-methylamino]acetic acid
CID 126849037
6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 122281906
2-(2-cyanopropan-2-yl)-N-[5-[6-(dimethylamino)-3-pyridinyl]-6-methyl-3-pyridinyl]pyridine-4-carboxamide
CID 155216263
[6-(2,2-dimethylpropylamino)pyrimidin-4-yl]-methylcyanamide
CID 115266078
2-(5-iodo-2-pyridinyl)-2-methylpropanenitrile
CID 139373118
2-(5-amino-1-methylpyrazol-3-yl)-2-methylpropanenitrile
CID 69038672

Frequently Asked Questions

What is the IUPAC name of 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile?
The IUPAC name of 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile (CID 130284263) is 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile.
What is the SMILES notation for 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile?
The canonical SMILES for 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile is CN(C)c1cc(C(C)(C)C#N)ncn1.
What is the InChIKey of 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile?
The InChIKey is LXLBSSUDDVISGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-10(2,6-11)8-5-9(14(3)4)13-7-12-8/h5,7H,1-4H3.
What are the key properties of 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile?
2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile has a molecular weight of 190.25 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(dimethylamino)pyrimidin-4-yl]-2-methylpropanenitrile is sourced from PubChem (CID 130284263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).