1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea

C15H24N4O2 — CID 51084139

IUPAC1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea
SMILESCC1CN(CCCNC(=O)Nc2ccccn2)CC(C)O1
InChIInChI=1S/C15H24N4O2/c1-12-10-19(11-13(2)21-12)9-5-8-17-15(20)18-14-6-3-4-7-16-14/h3-4,6-7,12-13H,5,8-11H2,1-2H3,(H2,16,17,18,20)
InChIKeyMKILQBCOUIOBTJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.70
Rot. Bonds5

About 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea

1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea (PubChem CID 51084139) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea.

Molecular Properties

Compound Name1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea
PubChem CID51084139
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea
SMILESCC1CN(CCCNC(=O)Nc2ccccn2)CC(C)O1
InChIInChI=1S/C15H24N4O2/c1-12-10-19(11-13(2)21-12)9-5-8-17-15(20)18-14-6-3-4-7-16-14/h3-4,6-7,12-13H,5,8-11H2,1-2H3,(H2,16,17,18,20)
InChIKeyMKILQBCOUIOBTJ-UHFFFAOYSA-N
XLogP1.70
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-phenylurea
CID 51333998
1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-(4-methylphenyl)urea
CID 51334002
1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-(4-fluorophenyl)urea
CID 51334001
1-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]methyl]-3-pyridin-2-ylurea
CID 94066593
1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]-3-(3-methyl-2-pyridinyl)urea
CID 94054024
1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-[3-(2-phenylethynyl)phenyl]urea
CID 112825463
1-[3-(dimethylamino)propyl]-3-pyridin-2-ylurea
CID 47237954
N-[3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propyl]pyridine-4-carboxamide
CID 51725583
1-(3-aminopropyl)-3-pyridin-2-ylurea
CID 110492095
1-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-3-[2-(pyrimidin-2-ylamino)ethyl]urea
CID 154774201
1-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]butyl]-3-(1,3,4-thiadiazol-2-yl)urea
CID 95975570
N-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 134024203

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea?
The IUPAC name of 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea (CID 51084139) is 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea.
What is the SMILES notation for 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea?
The canonical SMILES for 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea is CC1CN(CCCNC(=O)Nc2ccccn2)CC(C)O1.
What is the InChIKey of 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea?
The InChIKey is MKILQBCOUIOBTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-12-10-19(11-13(2)21-12)9-5-8-17-15(20)18-14-6-3-4-7-16-14/h3-4,6-7,12-13H,5,8-11H2,1-2H3,(H2,16,17,18,20).
What are the key properties of 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea?
1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea has a molecular weight of 292.38 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-3-pyridin-2-ylurea is sourced from PubChem (CID 51084139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).