2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide

C15H27N5O — CID 80987636

IUPAC2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide
SMILESCCCc1nc(N)c(C)c(N(CCC)CC(=O)N(C)C)n1
InChIInChI=1S/C15H27N5O/c1-6-8-12-17-14(16)11(3)15(18-12)20(9-7-2)10-13(21)19(4)5/h6-10H2,1-5H3,(H2,16,17,18)
InChIKeyMOOFDSBDWJMAKK-UHFFFAOYSA-N
MW293.42 g/mol
LogP1.62
Rot. Bonds7

About 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide

2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide (PubChem CID 80987636) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide
PubChem CID80987636
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC Name2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide
SMILESCCCc1nc(N)c(C)c(N(CCC)CC(=O)N(C)C)n1
InChIInChI=1S/C15H27N5O/c1-6-8-12-17-14(16)11(3)15(18-12)20(9-7-2)10-13(21)19(4)5/h6-10H2,1-5H3,(H2,16,17,18)
InChIKeyMOOFDSBDWJMAKK-UHFFFAOYSA-N
XLogP1.62
TPSA75.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide
CID 80994953
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-propylacetamide
CID 80986192
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-cyclopropylacetamide
CID 80983230
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-(2-methoxyethyl)acetamide
CID 80987749
2-[butyl-(6-chloro-5-methyl-2-propylpyrimidin-4-yl)amino]acetamide
CID 80972549
2-[(6-chloro-2-propylpyrimidin-4-yl)-ethylamino]-N,N-dimethylacetamide
CID 80939213
2-ethyl-4-N,5-dimethyl-4-N-propylpyrimidine-4,6-diamine
CID 80993286
2-[(2-amino-6-methylthieno[2,3-d]pyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide
CID 103326326
2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-propylamino]-N,N-dimethylacetamide
CID 107541801
2-[(6-aminoquinazolin-4-yl)-propylamino]-N,N-dimethylacetamide
CID 64589896
3-[2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)amino]ethyl]-1,1-dimethylurea
CID 83117399
2-[[3-(aminomethyl)pyrazin-2-yl]-propylamino]-N,N-dimethylacetamide
CID 62673047

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide (CID 80987636) is 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide is CCCc1nc(N)c(C)c(N(CCC)CC(=O)N(C)C)n1.
What is the InChIKey of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide?
The InChIKey is MOOFDSBDWJMAKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-6-8-12-17-14(16)11(3)15(18-12)20(9-7-2)10-13(21)19(4)5/h6-10H2,1-5H3,(H2,16,17,18).
What are the key properties of 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide?
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide has a molecular weight of 293.42 g/mol, XLogP of 1.62, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)-propylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 80987636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).