N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide

C10H17N5O — CID 80788685

IUPACN-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide
SMILESCCc1c(N)ncnc1NCCNC(C)=O
InChIInChI=1S/C10H17N5O/c1-3-8-9(11)14-6-15-10(8)13-5-4-12-7(2)16/h6H,3-5H2,1-2H3,(H,12,16)(H3,11,13,14,15)
InChIKeySELITDILIRWUDZ-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.17
Rot. Bonds5

About N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide

N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide (PubChem CID 80788685) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide
PubChem CID80788685
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC NameN-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide
SMILESCCc1c(N)ncnc1NCCNC(C)=O
InChIInChI=1S/C10H17N5O/c1-3-8-9(11)14-6-15-10(8)13-5-4-12-7(2)16/h6H,3-5H2,1-2H3,(H,12,16)(H3,11,13,14,15)
InChIKeySELITDILIRWUDZ-UHFFFAOYSA-N
XLogP0.17
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[(5-aminopyrimidin-4-yl)amino]ethyl]acetamide
CID 79917896
3-[(6-amino-5-ethylpyrimidin-4-yl)amino]propan-1-ol
CID 80770990
2-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethoxy]acetamide
CID 106241817
6-[(6-amino-5-ethylpyrimidin-4-yl)amino]hexan-1-ol
CID 107855342
2-[(6-amino-5-ethylpyrimidin-4-yl)amino]-N-propylpropanamide
CID 80800536
5-ethyl-4-N-methylpyrimidine-4,6-diamine
CID 80770928
N-[2-[(6-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethyl]acetamide
CID 110430172
3-[(6-amino-5-ethylpyrimidin-4-yl)amino]-3-methylbutanamide
CID 106098686
3-[(6-amino-5-ethylpyrimidin-4-yl)amino]-2,3-dimethylbutan-2-ol
CID 106198513
3-[(6-amino-5-ethylpyrimidin-4-yl)amino]-2,2-dimethylpropan-1-ol
CID 115366531
N-[2-[(6-aminopyrimidin-4-yl)amino]ethyl]acetamide
CID 79006981
5-ethyl-4-N-(2-thiomorpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 106327548

Frequently Asked Questions

What is the IUPAC name of N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide?
The IUPAC name of N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide (CID 80788685) is N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide.
What is the SMILES notation for N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide?
The canonical SMILES for N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide is CCc1c(N)ncnc1NCCNC(C)=O.
What is the InChIKey of N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide?
The InChIKey is SELITDILIRWUDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-3-8-9(11)14-6-15-10(8)13-5-4-12-7(2)16/h6H,3-5H2,1-2H3,(H,12,16)(H3,11,13,14,15).
What are the key properties of N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide?
N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide has a molecular weight of 223.28 g/mol, XLogP of 0.17, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(6-amino-5-ethylpyrimidin-4-yl)amino]ethyl]acetamide is sourced from PubChem (CID 80788685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).