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

C15H27N5 — CID 105420998

IUPAC4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)cc(N(C)CC2(N(C)C)CCC2)n1
InChIInChI=1S/C15H27N5/c1-5-7-13-17-12(16)10-14(18-13)20(4)11-15(19(2)3)8-6-9-15/h10H,5-9,11H2,1-4H3,(H2,16,17,18)
InChIKeyNHGOZTGTPNPAJY-UHFFFAOYSA-N
MW277.42 g/mol
LogP1.93
Rot. Bonds6

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

4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine (PubChem CID 105420998) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine
PubChem CID105420998
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)cc(N(C)CC2(N(C)C)CCC2)n1
InChIInChI=1S/C15H27N5/c1-5-7-13-17-12(16)10-14(18-13)20(4)11-15(19(2)3)8-6-9-15/h10H,5-9,11H2,1-4H3,(H2,16,17,18)
InChIKeyNHGOZTGTPNPAJY-UHFFFAOYSA-N
XLogP1.93
TPSA58.28 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 ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-(methoxymethyl)-4-N-methylpyrimidine-4,6-diamine
CID 105420936
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N,6-N-dimethyl-2-propylpyrimidine-4,6-diamine
CID 105420923
4-N-methyl-4-N-(2-methylpropyl)-2-propylpyrimidine-4,6-diamine
CID 80954780
4-(chloromethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-6-propylpyridin-2-amine
CID 105416214
2-[(6-amino-2-propylpyrimidin-4-yl)-methylamino]cyclohexan-1-ol
CID 102640210
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N-ethyl-4-N,6-dimethylpyrimidine-2,4-diamine
CID 105420925
3-[[(6-amino-2-propylpyrimidin-4-yl)-methylamino]methyl]cyclobutan-1-ol
CID 80949667
4-N-methyl-4-N-[(4-methylphenyl)methyl]-2-propylpyrimidine-4,6-diamine
CID 80945206
2-propylpyrimidine-4,6-diamine
CID 67304918
4-N-methyl-4-N-(2-propan-2-yloxyethyl)-2-propylpyrimidine-4,6-diamine
CID 81068729
6-bromo-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,2-dimethylpyrimidin-4-amine
CID 105419888
2-[(6-amino-2-propylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 104557134

Frequently Asked Questions

What is the IUPAC name of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine (CID 105420998) is 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine is CCCc1nc(N)cc(N(C)CC2(N(C)C)CCC2)n1.
What is the InChIKey of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine?
The InChIKey is NHGOZTGTPNPAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-5-7-13-17-12(16)10-14(18-13)20(4)11-15(19(2)3)8-6-9-15/h10H,5-9,11H2,1-4H3,(H2,16,17,18).
What are the key properties of 4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine?
4-N-[[1-(dimethylamino)cyclobutyl]methyl]-4-N-methyl-2-propylpyrimidine-4,6-diamine has a molecular weight of 277.42 g/mol, XLogP of 1.93, 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]-4-N-methyl-2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 105420998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).