4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine

C14H24N4 — CID 80982436

IUPAC4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NC)c(C)c(NC2CC2(C)C)n1
InChIInChI=1S/C14H24N4/c1-6-7-11-17-12(15-5)9(2)13(18-11)16-10-8-14(10,3)4/h10H,6-8H2,1-5H3,(H2,15,16,17,18)
InChIKeyPLZOBEYBHVTZMN-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.99
Rot. Bonds5

About 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine

4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine (PubChem CID 80982436) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
PubChem CID80982436
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NC)c(C)c(NC2CC2(C)C)n1
InChIInChI=1S/C14H24N4/c1-6-7-11-17-12(15-5)9(2)13(18-11)16-10-8-14(10,3)4/h10H,6-8H2,1-5H3,(H2,15,16,17,18)
InChIKeyPLZOBEYBHVTZMN-UHFFFAOYSA-N
XLogP2.99
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-N,5-dimethyl-4-N-(2-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 80985581
6-N,5-dimethyl-4-N-(2-methylcycloheptyl)-2-propylpyrimidine-4,6-diamine
CID 80992645
4-N-(1-azabicyclo[2.2.2]octan-3-yl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
CID 80981730
N-(4,4-dimethylcyclohexyl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 81006435
4-N-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80982653
4-N-(4,4-dimethylcyclohexyl)-2-ethyl-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80984810
4-[[[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 106138586
4-N-(2,2-dimethylcyclopropyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80819298
6-N,5-dimethyl-4-N-(4-methylhexan-2-yl)-2-propylpyrimidine-4,6-diamine
CID 80991797
4-N-[2-(dimethylamino)propyl]-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
CID 80982651
3-[[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-1-ol
CID 80981891
6-N,5-dimethyl-4-N-(oxolan-3-ylmethyl)-2-propylpyrimidine-4,6-diamine
CID 80983011

Frequently Asked Questions

What is the IUPAC name of 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine (CID 80982436) is 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine is CCCc1nc(NC)c(C)c(NC2CC2(C)C)n1.
What is the InChIKey of 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
The InChIKey is PLZOBEYBHVTZMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-6-7-11-17-12(15-5)9(2)13(18-11)16-10-8-14(10,3)4/h10H,6-8H2,1-5H3,(H2,15,16,17,18).
What are the key properties of 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine?
4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine has a molecular weight of 248.37 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2,2-dimethylcyclopropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 80982436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).