4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine

C15H27N5 — CID 105420925

IUPAC4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(N(C)CC2(N(C)C)CCC2)n1
InChIInChI=1S/C15H27N5/c1-6-16-14-17-12(2)10-13(18-14)20(5)11-15(19(3)4)8-7-9-15/h10H,6-9,11H2,1-5H3,(H,16,17,18)
InChIKeyZOAPBAKWWIDQLL-UHFFFAOYSA-N
MW277.42 g/mol
LogP2.14
Rot. Bonds6

About 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine

4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine (PubChem CID 105420925) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine
PubChem CID105420925
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine
SMILESCCNc1nc(C)cc(N(C)CC2(N(C)C)CCC2)n1
InChIInChI=1S/C15H27N5/c1-6-16-14-17-12(2)10-13(18-14)20(5)11-15(19(3)4)8-7-9-15/h10H,6-9,11H2,1-5H3,(H,16,17,18)
InChIKeyZOAPBAKWWIDQLL-UHFFFAOYSA-N
XLogP2.14
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine with MolForge

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Related Compounds

4-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine
CID 83118042
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine
CID 105420998
6-bromo-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,2-dimethylpyrimidin-4-amine
CID 105419888
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N,6-N-dimethyl-2-propylpyrimidine-4,6-diamine
CID 105420923
4-N-(cyclobutylmethyl)-2-N,4-N-diethyl-6-methylpyrimidine-2,4-diamine
CID 107403115
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-6-N-ethyl-4-N,2,5-trimethylpyrimidine-4,6-diamine
CID 105420985
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-(methoxymethyl)-4-N-methylpyrimidine-4,6-diamine
CID 105420936
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-6-N-propylpyrimidine-4,6-diamine
CID 105420977
N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 105421058
N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 105421075
4-N-(2,4-dimethylphenyl)-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine
CID 80818316
2-N-ethyl-6-methyl-4-N-propan-2-yl-4-N-propylpyrimidine-2,4-diamine
CID 80775316

Frequently Asked Questions

What is the IUPAC name of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
The IUPAC name of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine (CID 105420925) is 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
The canonical SMILES for 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine is CCNc1nc(C)cc(N(C)CC2(N(C)C)CCC2)n1.
What is the InChIKey of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
The InChIKey is ZOAPBAKWWIDQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-6-16-14-17-12(2)10-13(18-14)20(5)11-15(19(3)4)8-7-9-15/h10H,6-9,11H2,1-5H3,(H,16,17,18).
What are the key properties of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine?
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine has a molecular weight of 277.42 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine is sourced from PubChem (CID 105420925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).