N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide

C10H16N4O3 — CID 137016272

IUPACN-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide
SMILESCCNC(=O)C(C)Nc1nc[nH]c(=O)c1OC
InChIInChI=1S/C10H16N4O3/c1-4-11-9(15)6(2)14-8-7(17-3)10(16)13-5-12-8/h5-6H,4H2,1-3H3,(H,11,15)(H2,12,13,14,16)
InChIKeyYFPVAHHYLKTTTA-UHFFFAOYSA-N
MW240.26 g/mol
LogP-0.28
Rot. Bonds5

About N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide

N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide (PubChem CID 137016272) has the molecular formula C10H16N4O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide
PubChem CID137016272
Molecular FormulaC10H16N4O3
Molecular Weight240.26 g/mol
Exact Mass240.12
IUPAC NameN-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide
SMILESCCNC(=O)C(C)Nc1nc[nH]c(=O)c1OC
InChIInChI=1S/C10H16N4O3/c1-4-11-9(15)6(2)14-8-7(17-3)10(16)13-5-12-8/h5-6H,4H2,1-3H3,(H,11,15)(H2,12,13,14,16)
InChIKeyYFPVAHHYLKTTTA-UHFFFAOYSA-N
XLogP-0.28
TPSA96.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]-N-methylpropanamide
CID 136980716
2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 136974783
3-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]butanamide
CID 136977320
4-[[(2S)-1-hydroxy-3-methylbutan-2-yl]amino]-5-methoxy-1H-pyrimidin-6-one
CID 136949437
3-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]-2-methylbutanoic acid
CID 136972381
3-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]hexanoic acid
CID 136972316
2-[(5-bromo-6-oxo-1H-pyrimidin-4-yl)amino]-N-propylpropanamide
CID 136956505
4-(1-cyclopropylethylamino)-5-methoxy-1H-pyrimidin-6-one
CID 136973988
5-methoxy-4-[1-(1H-1,2,4-triazol-5-yl)ethylamino]-1H-pyrimidin-6-one
CID 136817732
4-[(2-hydroxy-3-methylbutyl)amino]-5-methoxy-1H-pyrimidin-6-one
CID 136977261
5-methoxy-4-(1-pyrazol-1-ylpropan-2-ylamino)-1H-pyrimidin-6-one
CID 137016246
4-(2-ethylbutylamino)-5-methoxy-1H-pyrimidin-6-one
CID 136977399

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide?
The IUPAC name of N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide (CID 137016272) is N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide.
What is the SMILES notation for N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide?
The canonical SMILES for N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide is CCNC(=O)C(C)Nc1nc[nH]c(=O)c1OC.
What is the InChIKey of N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide?
The InChIKey is YFPVAHHYLKTTTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3/c1-4-11-9(15)6(2)14-8-7(17-3)10(16)13-5-12-8/h5-6H,4H2,1-3H3,(H,11,15)(H2,12,13,14,16).
What are the key properties of N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide?
N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide has a molecular weight of 240.26 g/mol, XLogP of -0.28, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(5-methoxy-6-oxo-1H-pyrimidin-4-yl)amino]propanamide is sourced from PubChem (CID 137016272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).