2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide

C11H19N5O — CID 80935004

IUPAC2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide
SMILESCCNC(=O)C(C)Nc1cc(N)nc(CC)n1
InChIInChI=1S/C11H19N5O/c1-4-9-15-8(12)6-10(16-9)14-7(3)11(17)13-5-2/h6-7H,4-5H2,1-3H3,(H,13,17)(H3,12,14,15,16)
InChIKeyMSWDUQCTSNHQRH-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.56
Rot. Bonds5

About 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide

2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide (PubChem CID 80935004) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide.

Molecular Properties

Compound Name2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide
PubChem CID80935004
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide
SMILESCCNC(=O)C(C)Nc1cc(N)nc(CC)n1
InChIInChI=1S/C11H19N5O/c1-4-9-15-8(12)6-10(16-9)14-7(3)11(17)13-5-2/h6-7H,4-5H2,1-3H3,(H,13,17)(H3,12,14,15,16)
InChIKeyMSWDUQCTSNHQRH-UHFFFAOYSA-N
XLogP0.56
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]propanoate
CID 80935382
methyl 2-[(6-amino-2-propylpyrimidin-4-yl)amino]propanoate
CID 80955368
ethyl 2-[(6-amino-2-propylpyrimidin-4-yl)amino]propanoate
CID 80954453
2-ethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine
CID 80933934
N-ethyl-2-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]propanamide
CID 80800769
N-ethyl-2-[[2-(ethylamino)-6-(trifluoromethyl)pyrimidin-4-yl]amino]propanamide
CID 114564470
N-ethyl-2-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]propanamide
CID 65276938
N-ethyl-2-[(6-methyl-2-pyridinyl)amino]propanamide
CID 61480114
2-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]amino]-N-ethylpropanamide
CID 102715642
2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-ethylpropanamide
CID 60665444
2-ethyl-4-N-octan-4-ylpyrimidine-4,6-diamine
CID 106028697
2-[(6-chloro-2-phenylpyrimidin-4-yl)amino]-N-ethylpropanamide
CID 115914717

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide?
The IUPAC name of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide (CID 80935004) is 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide.
What is the SMILES notation for 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide?
The canonical SMILES for 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide is CCNC(=O)C(C)Nc1cc(N)nc(CC)n1.
What is the InChIKey of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide?
The InChIKey is MSWDUQCTSNHQRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-4-9-15-8(12)6-10(16-9)14-7(3)11(17)13-5-2/h6-7H,4-5H2,1-3H3,(H,13,17)(H3,12,14,15,16).
What are the key properties of 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide?
2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide has a molecular weight of 237.31 g/mol, XLogP of 0.56, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-N-ethylpropanamide is sourced from PubChem (CID 80935004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).