2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide

C14H25N5O2 — CID 106241892

IUPAC2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide
SMILESCCCNc1cc(NCCOCC(N)=O)nc(CCC)n1
InChIInChI=1S/C14H25N5O2/c1-3-5-12-18-13(16-6-4-2)9-14(19-12)17-7-8-21-10-11(15)20/h9H,3-8,10H2,1-2H3,(H2,15,20)(H2,16,17,18,19)
InChIKeyACMDSISRQZEYPL-UHFFFAOYSA-N
MW295.39 g/mol
LogP1.16
Rot. Bonds11

About 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide

2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide (PubChem CID 106241892) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide
PubChem CID106241892
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC Name2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide
SMILESCCCNc1cc(NCCOCC(N)=O)nc(CCC)n1
InChIInChI=1S/C14H25N5O2/c1-3-5-12-18-13(16-6-4-2)9-14(19-12)17-7-8-21-10-11(15)20/h9H,3-8,10H2,1-2H3,(H2,15,20)(H2,16,17,18,19)
InChIKeyACMDSISRQZEYPL-UHFFFAOYSA-N
XLogP1.16
TPSA102.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]ethoxy]acetamide
CID 106241808
2-[2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]acetamide
CID 106242008
2-[2-[[6-(propylamino)-2-pyridinyl]amino]ethoxy]acetamide
CID 106241754
methyl 3-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]propanoate
CID 80954586
2-[2-[[6-chloro-2-(methoxymethyl)pyrimidin-4-yl]amino]ethoxy]acetamide
CID 114162689
2-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80945317
2-[ethyl-[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 103104455
N-propyl-2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80942500
2-[2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide
CID 106239169
6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine
CID 80946214
4-N-butyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80946225
3-[[2-ethyl-6-(propylamino)pyrimidin-4-yl]amino]propanamide
CID 80933122

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide?
The IUPAC name of 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide (CID 106241892) is 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide is CCCNc1cc(NCCOCC(N)=O)nc(CCC)n1.
What is the InChIKey of 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide?
The InChIKey is ACMDSISRQZEYPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-3-5-12-18-13(16-6-4-2)9-14(19-12)17-7-8-21-10-11(15)20/h9H,3-8,10H2,1-2H3,(H2,15,20)(H2,16,17,18,19).
What are the key properties of 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide?
2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide has a molecular weight of 295.39 g/mol, XLogP of 1.16, 11 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]ethoxy]acetamide is sourced from PubChem (CID 106241892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).