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

C11H19N5O — CID 80787425

IUPACN-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide
SMILESCCNC(=O)CNc1ncnc(NCC)c1C
InChIInChI=1S/C11H19N5O/c1-4-12-9(17)6-14-11-8(3)10(13-5-2)15-7-16-11/h7H,4-6H2,1-3H3,(H,12,17)(H2,13,14,15,16)
InChIKeyYBSATZYFPFOTAK-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.76
Rot. Bonds6

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

N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide (PubChem CID 80787425) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide
PubChem CID80787425
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC NameN-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide
SMILESCCNC(=O)CNc1ncnc(NCC)c1C
InChIInChI=1S/C11H19N5O/c1-4-12-9(17)6-14-11-8(3)10(13-5-2)15-7-16-11/h7H,4-6H2,1-3H3,(H,12,17)(H2,13,14,15,16)
InChIKeyYBSATZYFPFOTAK-UHFFFAOYSA-N
XLogP0.76
TPSA78.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
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

N-ethyl-2-[[5-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 80788303
3-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]propanamide
CID 80787743
3-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-N,2,2-trimethylpropanamide
CID 106280708
2-[[5-bromo-6-(ethylamino)pyrimidin-4-yl]-methylamino]-N-ethylacetamide
CID 114072094
4-N-(2,2-dimethylbutyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 103466542
N-ethyl-2-[6-(ethylamino)-5-methoxypyrimidin-4-yl]sulfanylacetamide
CID 114235128
2-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]-N-methylacetamide
CID 80994288
2-[(4-amino-1,3,5-triazin-2-yl)amino]-N-ethylacetamide
CID 126979187
6-chloro-N-ethyl-5-methylpyrimidin-4-amine
CID 63734594
N-cyclopropyl-2-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]acetamide
CID 80907485
2-[(5,6-dimethylpyrimidin-4-yl)amino]acetic acid
CID 83619945
2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]-N-ethylacetamide
CID 80994073

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide?
The IUPAC name of N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide (CID 80787425) is N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide is CCNC(=O)CNc1ncnc(NCC)c1C.
What is the InChIKey of N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide?
The InChIKey is YBSATZYFPFOTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-4-12-9(17)6-14-11-8(3)10(13-5-2)15-7-16-11/h7H,4-6H2,1-3H3,(H,12,17)(H2,13,14,15,16).
What are the key properties of N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide?
N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide has a molecular weight of 237.31 g/mol, XLogP of 0.76, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80787425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).