1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione

C14H24N4O3 — CID 28673022

IUPAC1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione
SMILESCn1cc(CNCCCN2CCOCC2)c(=O)n(C)c1=O
InChIInChI=1S/C14H24N4O3/c1-16-11-12(13(19)17(2)14(16)20)10-15-4-3-5-18-6-8-21-9-7-18/h11,15H,3-10H2,1-2H3
InChIKeyMPSLGKNTBNVSCF-UHFFFAOYSA-N
MW296.37 g/mol
LogP-1.10
Rot. Bonds6

About 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione

1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione (PubChem CID 28673022) has the molecular formula C14H24N4O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione
PubChem CID28673022
Molecular FormulaC14H24N4O3
Molecular Weight296.37 g/mol
Exact Mass296.18
IUPAC Name1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione
SMILESCn1cc(CNCCCN2CCOCC2)c(=O)n(C)c1=O
InChIInChI=1S/C14H24N4O3/c1-16-11-12(13(19)17(2)14(16)20)10-15-4-3-5-18-6-8-21-9-7-18/h11,15H,3-10H2,1-2H3
InChIKeyMPSLGKNTBNVSCF-UHFFFAOYSA-N
XLogP-1.10
TPSA68.50 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 5-1.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione 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

5-(4-Morpholinylmethyl)-2,4-pyrimidinediol
CID 235247
1,3-dimethyl-6-(3-morpholin-4-ylpropyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
CID 667038
2-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-N-(2-morpholinoethyl)acetamide
CID 45280787
1,3-dimethyl-6-(2-morpholin-4-ylethyl)-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidine-2,4-dione
CID 672080
5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}pyrimidine-2,4(1H,3H)-dione
CID 642664
5-(Morpholin-4-ylmethylidene)-1,3-diazinane-2,4,6-trione
CID 21177786
5-[(2,2-dimethylmorpholin-4-yl)carbonyl]-1-methylpyrimidine-2,4(1H,3H)-dione
CID 90648187
5-[(3S)-3-propylmorpholine-4-carbonyl]-1H-pyrimidine-2,4-dione
CID 95219842
1-[N-(2-morpholinocarbonylethyl)carbamoyl]-5-fluorouracil
CID 20525053
2-Methyl-N-[(morpholin-4-yl)methyl]prop-2-enamide
CID 21536823
5-Methyl-1-[2-[2-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)ethoxy]ethoxy]ethyl]pyrimidine-2,4-dione
CID 5256539
5-(4-Methylpiperazinomethyl)uracil
CID 15031088

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione?
The IUPAC name of 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione (CID 28673022) is 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione.
What is the SMILES notation for 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione?
The canonical SMILES for 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione is Cn1cc(CNCCCN2CCOCC2)c(=O)n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione?
The InChIKey is MPSLGKNTBNVSCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3/c1-16-11-12(13(19)17(2)14(16)20)10-15-4-3-5-18-6-8-21-9-7-18/h11,15H,3-10H2,1-2H3.
What are the key properties of 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione?
1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione has a molecular weight of 296.37 g/mol, XLogP of -1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-[(3-morpholin-4-ylpropylamino)methyl]pyrimidine-2,4-dione is sourced from PubChem (CID 28673022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).