2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine

C13H22N4 — CID 80848684

IUPAC2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine
SMILESCNc1nc(C)cc(NC2C(C)(C)C2(C)C)n1
InChIInChI=1S/C13H22N4/c1-8-7-9(17-11(14-6)15-8)16-10-12(2,3)13(10,4)5/h7,10H,1-6H3,(H2,14,15,16,17)
InChIKeyJWXLTWHCKWDRAZ-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.67
Rot. Bonds3

About 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine

2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine (PubChem CID 80848684) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine
PubChem CID80848684
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine
SMILESCNc1nc(C)cc(NC2C(C)(C)C2(C)C)n1
InChIInChI=1S/C13H22N4/c1-8-7-9(17-11(14-6)15-8)16-10-12(2,3)13(10,4)5/h7,10H,1-6H3,(H2,14,15,16,17)
InChIKeyJWXLTWHCKWDRAZ-UHFFFAOYSA-N
XLogP2.67
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80769558
3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol
CID 80856009
2-N,6-dimethyl-4-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine
CID 80772502
4-N-(2,4-dimethylcyclohexyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80835388
4-N-(3,4-dimethylphenyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80754824
2-N,6-dimethyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80797834
2-N,6-dimethyl-4-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]pyrimidine-2,4-diamine
CID 135114364
2-N,6-dimethyl-4-N-thiophen-3-ylpyrimidine-2,4-diamine
CID 80850538
2-N,6-dimethyl-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 80760167
4-N-(2-iodophenyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80762709
4-N-(2,2-dimethylbutyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 103466603
4-N-[1-(4-chlorophenyl)ethyl]-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80801489

Frequently Asked Questions

What is the IUPAC name of 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine?
The IUPAC name of 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine (CID 80848684) is 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine?
The canonical SMILES for 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine is CNc1nc(C)cc(NC2C(C)(C)C2(C)C)n1.
What is the InChIKey of 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine?
The InChIKey is JWXLTWHCKWDRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-8-7-9(17-11(14-6)15-8)16-10-12(2,3)13(10,4)5/h7,10H,1-6H3,(H2,14,15,16,17).
What are the key properties of 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine?
2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine has a molecular weight of 234.35 g/mol, XLogP of 2.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 80848684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).