1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea

C11H16N4O2 — CID 47162241

IUPAC1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
SMILESCNC(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C11H16N4O2/c1-12-11(16)14-9-2-3-10(13-8-9)15-4-6-17-7-5-15/h2-3,8H,4-7H2,1H3,(H2,12,14,16)
InChIKeyROLPKDPQJSJDDV-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.67
Rot. Bonds2

About 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea

1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea (PubChem CID 47162241) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea.

Molecular Properties

Compound Name1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
PubChem CID47162241
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
SMILESCNC(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C11H16N4O2/c1-12-11(16)14-9-2-3-10(13-8-9)15-4-6-17-7-5-15/h2-3,8H,4-7H2,1H3,(H2,12,14,16)
InChIKeyROLPKDPQJSJDDV-UHFFFAOYSA-N
XLogP0.67
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 11391397
1-(2-hydroxypropyl)-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47221090
N-(6-morpholin-4-yl-3-pyridinyl)prop-2-enamide
CID 43699902
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953
1-[(2R)-1-hydroxy-2-methylbutan-2-yl]-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 95772331
1-[(2S)-2-hydroxy-2-methylbutyl]-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 95156925
(2S)-2-amino-3-methyl-N-(6-morpholin-4-yl-3-pyridinyl)butanamide
CID 61180630
4-[(6-morpholin-4-yl-3-pyridinyl)amino]-4-oxobutanoic acid
CID 39180266
(2S)-2-amino-N-(6-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
CID 119839706
2-(carbamoylamino)-N-(6-morpholin-4-yl-3-pyridinyl)propanamide
CID 43044639
1-(1,1-dioxothiolan-3-yl)-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 53498070
1-(3-fluoro-4-pyrrolidin-1-ylphenyl)-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 48795694

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
The IUPAC name of 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea (CID 47162241) is 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea.
What is the SMILES notation for 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
The canonical SMILES for 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea is CNC(=O)Nc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
The InChIKey is ROLPKDPQJSJDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c1-12-11(16)14-9-2-3-10(13-8-9)15-4-6-17-7-5-15/h2-3,8H,4-7H2,1H3,(H2,12,14,16).
What are the key properties of 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea?
1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea has a molecular weight of 236.27 g/mol, XLogP of 0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea is sourced from PubChem (CID 47162241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).