N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide

C10H15IN4O — CID 104839933

IUPACN-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide
SMILESCCNC(=O)CN(CC)c1ncc(I)cn1
InChIInChI=1S/C10H15IN4O/c1-3-12-9(16)7-15(4-2)10-13-5-8(11)6-14-10/h5-6H,3-4,7H2,1-2H3,(H,12,16)
InChIKeyCDRVWJUJYAHKME-UHFFFAOYSA-N
MW334.16 g/mol
LogP1.04
Rot. Bonds5

About N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide

N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide (PubChem CID 104839933) has the molecular formula C10H15IN4O and a molecular weight of 334.16 g/mol. Its IUPAC name is N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide
PubChem CID104839933
Molecular FormulaC10H15IN4O
Molecular Weight334.16 g/mol
Exact Mass334.03
IUPAC NameN-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide
SMILESCCNC(=O)CN(CC)c1ncc(I)cn1
InChIInChI=1S/C10H15IN4O/c1-3-12-9(16)7-15(4-2)10-13-5-8(11)6-14-10/h5-6H,3-4,7H2,1-2H3,(H,12,16)
InChIKeyCDRVWJUJYAHKME-UHFFFAOYSA-N
XLogP1.04
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.16
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]pyrimidine-5-carboxylic acid
CID 113387735
N-ethyl-2-[(5-iodopyrimidin-2-yl)amino]acetamide
CID 104839942
3-[ethyl-(5-iodopyrimidin-2-yl)amino]propan-1-ol
CID 104843994
5-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]pyridine-2-carboxylic acid
CID 104638828
2-[(2,5-dichloropyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 79633316
2-[(2-chloro-5-methylpyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 79072774
N-ethyl-2-[ethyl-[6-(1-hydroxyethyl)-3-pyridinyl]amino]acetamide
CID 83132139
5-amino-6-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]pyridine-3-carboxylic acid
CID 81439403
N-ethyl-2-[ethyl-(5-sulfamoyl-1,3-thiazol-2-yl)amino]acetamide
CID 133382749
2-[[5-bromo-2-(ethylamino)pyrimidin-4-yl]-ethylamino]-N-ethylacetamide
CID 80805068
2-[(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-ethylamino]-N-ethylacetamide
CID 62858007
2-[(3-chloro-2-pyridinyl)-ethylamino]-N-ethylacetamide
CID 133382755

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide (CID 104839933) is N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide is CCNC(=O)CN(CC)c1ncc(I)cn1.
What is the InChIKey of N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide?
The InChIKey is CDRVWJUJYAHKME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15IN4O/c1-3-12-9(16)7-15(4-2)10-13-5-8(11)6-14-10/h5-6H,3-4,7H2,1-2H3,(H,12,16).
What are the key properties of N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide?
N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide has a molecular weight of 334.16 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[ethyl-(5-iodopyrimidin-2-yl)amino]acetamide is sourced from PubChem (CID 104839933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).