2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide

C11H19N5O — CID 80945317

IUPAC2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
SMILESCCCc1nc(NCC)cc(NCC(N)=O)n1
InChIInChI=1S/C11H19N5O/c1-3-5-9-15-10(13-4-2)6-11(16-9)14-7-8(12)17/h6H,3-5,7H2,1-2H3,(H2,12,17)(H2,13,14,15,16)
InChIKeyJXEBKMTVKGEQHO-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.76
Rot. Bonds7

About 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide

2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide (PubChem CID 80945317) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound Name2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
PubChem CID80945317
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
SMILESCCCc1nc(NCC)cc(NCC(N)=O)n1
InChIInChI=1S/C11H19N5O/c1-3-5-9-15-10(13-4-2)6-11(16-9)14-7-8(12)17/h6H,3-5,7H2,1-2H3,(H2,12,17)(H2,13,14,15,16)
InChIKeyJXEBKMTVKGEQHO-UHFFFAOYSA-N
XLogP0.76
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]-N-methylacetamide
CID 80955338
2-[2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]ethoxy]acetamide
CID 106241808
N-cyclopropyl-2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80955065
4-N-ethyl-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80946507
N-methyl-2-[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80955339
N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80942500
N-ethyl-2-[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80954429
2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide
CID 106241892
3-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80933202
6-N-ethyl-4-N-(2-methyl-2-methylsulfonylpropyl)-2-propylpyrimidine-4,6-diamine
CID 80943193
4-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]butanamide
CID 80933799
2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]-N-methylpropanamide
CID 80954522

Frequently Asked Questions

What is the IUPAC name of 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide?
The IUPAC name of 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide (CID 80945317) is 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide?
The canonical SMILES for 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide is CCCc1nc(NCC)cc(NCC(N)=O)n1.
What is the InChIKey of 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide?
The InChIKey is JXEBKMTVKGEQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-3-5-9-15-10(13-4-2)6-11(16-9)14-7-8(12)17/h6H,3-5,7H2,1-2H3,(H2,12,17)(H2,13,14,15,16).
What are the key properties of 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide?
2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide has a molecular weight of 237.31 g/mol, XLogP of 0.76, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80945317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).