4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine

C12H22N4 — CID 80819241

IUPAC4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
SMILESCNc1nc(C)cc(N(C)CC(C)(C)C)n1
InChIInChI=1S/C12H22N4/c1-9-7-10(15-11(13-5)14-9)16(6)8-12(2,3)4/h7H,8H2,1-6H3,(H,13,14,15)
InChIKeyOMBUVZPAZZBRAT-UHFFFAOYSA-N
MW222.34 g/mol
LogP2.31
Rot. Bonds3

About 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine

4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine (PubChem CID 80819241) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
PubChem CID80819241
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
SMILESCNc1nc(C)cc(N(C)CC(C)(C)C)n1
InChIInChI=1S/C12H22N4/c1-9-7-10(15-11(13-5)14-9)16(6)8-12(2,3)4/h7H,8H2,1-6H3,(H,13,14,15)
InChIKeyOMBUVZPAZZBRAT-UHFFFAOYSA-N
XLogP2.31
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dimethylpropyl)-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
CID 80903777
2-chloro-N-(2,2-dimethylpropyl)-N,6-dimethylpyrimidin-4-amine
CID 62482205
N,N-dimethyl-2-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]acetamide
CID 80779921
4-N-(cyclopentylmethyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
CID 80833627
2-N,4-N,6-trimethyl-4-N-propan-2-ylpyrimidine-2,4-diamine
CID 80764020
1-methoxy-3-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80811552
4-N-[(2-chlorophenyl)methyl]-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
CID 80794819
4-N-cyclopropyl-2-N,6-dimethyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-2,4-diamine
CID 80815269
2-N,4-N,6-trimethyl-4-N-phenylpyrimidine-2,4-diamine
CID 19754221
4-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine
CID 80833914
3-[methyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]butanenitrile
CID 80829150
4-N-ethyl-2-N,6-dimethyl-4-N-(2-methylpropyl)pyrimidine-2,4-diamine
CID 80774522

Frequently Asked Questions

What is the IUPAC name of 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine (CID 80819241) is 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine is CNc1nc(C)cc(N(C)CC(C)(C)C)n1.
What is the InChIKey of 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine?
The InChIKey is OMBUVZPAZZBRAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-9-7-10(15-11(13-5)14-9)16(6)8-12(2,3)4/h7H,8H2,1-6H3,(H,13,14,15).
What are the key properties of 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine?
4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine has a molecular weight of 222.34 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2,2-dimethylpropyl)-2-N,4-N,6-trimethylpyrimidine-2,4-diamine is sourced from PubChem (CID 80819241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).