1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one

C8H15N3O — CID 143719964

IUPAC1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one
SMILESCCCC1CN=CN(NC)C1=O
InChIInChI=1S/C8H15N3O/c1-3-4-7-5-10-6-11(9-2)8(7)12/h6-7,9H,3-5H2,1-2H3
InChIKeyAYIVRYNAHKRYQI-UHFFFAOYSA-N
MW169.23 g/mol
LogP0.41
Rot. Bonds3

About 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one

1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one (PubChem CID 143719964) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one.

Molecular Properties

Compound Name1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one
PubChem CID143719964
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one
SMILESCCCC1CN=CN(NC)C1=O
InChIInChI=1S/C8H15N3O/c1-3-4-7-5-10-6-11(9-2)8(7)12/h6-7,9H,3-5H2,1-2H3
InChIKeyAYIVRYNAHKRYQI-UHFFFAOYSA-N
XLogP0.41
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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(3R,5R)-5-[2-(ethylamino)-1,3-thiazol-4-yl]-5-methyl-3-propyloxolan-2-one
CID 1096885
7-methyl-3-propyl-1,3,4,5-tetrahydropyrido[2,3-b][1,4]diazepin-2-one
CID 81136963
(3R,5R)-5-methyl-5-[2-[2-[[4-[(2R,4R)-2-methyl-5-oxo-4-propyloxolan-2-yl]-1,3-thiazol-2-yl]amino]ethylamino]-1,3-thiazol-4-yl]-3-propyloxolan-2-one
CID 25420439
1-(4-phosphanylphenyl)-3-propylazetidin-2-one
CID 143276517
trans-(2S,6S)-2,6-dipropylcyclohexan-1-one
CID 12712312
1-[2-[2-[2-[2-(2,5-dioxo-3-tetracontylpyrrolidin-1-yl)ethylamino]ethylamino]ethylamino]ethyl]-3-octatriacontylpyrrolidine-2,5-dione
CID 101132520
1-[2-[2-[2-[2-(3-dotetracontyl-2,5-dioxopyrrolidin-1-yl)ethylamino]ethylamino]ethylamino]ethyl]-3-tetracontylpyrrolidine-2,5-dione
CID 101132594
1-[2-[2-[2-[2-(2,5-dioxo-3-tetracontylpyrrolidin-1-yl)ethylamino]ethylamino]ethylamino]ethyl]-3-tetracontylpyrrolidine-2,5-dione
CID 90684404
1-hydroxy-3-propyl-3,4-dihydroquinolin-2-one
CID 119085152
(2,5-dioxo-3-propylpyrrolidin-1-yl) hydrogen sulfite
CID 174738579

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one?
The IUPAC name of 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one (CID 143719964) is 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one.
What is the SMILES notation for 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one?
The canonical SMILES for 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one is CCCC1CN=CN(NC)C1=O.
What is the InChIKey of 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one?
The InChIKey is AYIVRYNAHKRYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-3-4-7-5-10-6-11(9-2)8(7)12/h6-7,9H,3-5H2,1-2H3.
What are the key properties of 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one?
1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one has a molecular weight of 169.23 g/mol, XLogP of 0.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-5-propyl-4,5-dihydropyrimidin-6-one is sourced from PubChem (CID 143719964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).