1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea

C18H26N4O2 — CID 2467512

IUPAC1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea
SMILESO=C(NN=Cc1ccc(N2CCOCC2)cc1)NC1CCCCC1
InChIInChI=1S/C18H26N4O2/c23-18(20-16-4-2-1-3-5-16)21-19-14-15-6-8-17(9-7-15)22-10-12-24-13-11-22/h6-9,14,16H,1-5,10-13H2,(H2,20,21,23)
InChIKeyFCPLMMTWULFROT-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.49
Rot. Bonds4

About 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea

1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea (PubChem CID 2467512) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea.

Molecular Properties

Compound Name1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea
PubChem CID2467512
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC Name1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea
SMILESO=C(NN=Cc1ccc(N2CCOCC2)cc1)NC1CCCCC1
InChIInChI=1S/C18H26N4O2/c23-18(20-16-4-2-1-3-5-16)21-19-14-15-6-8-17(9-7-15)22-10-12-24-13-11-22/h6-9,14,16H,1-5,10-13H2,(H2,20,21,23)
InChIKeyFCPLMMTWULFROT-UHFFFAOYSA-N
XLogP2.49
TPSA65.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-cyclohexyl-3-(pyridin-4-ylmethylideneamino)urea
CID 2407544
1,3-bis[(E)-(4-morpholin-4-ylphenyl)methylideneamino]thiourea
CID 6905503
1-[(1R,2S)-2-methylcyclohexyl]-3-[(Z)-(4-morpholin-4-ylphenyl)methylideneamino]thiourea
CID 9122070
N-[(E)-(4-hydroxyphenyl)methylideneamino]-4-morpholin-4-ylbenzamide
CID 135932618
[(4-morpholin-4-ylphenyl)methylideneamino]thiourea
CID 957717
tert-butyl N-[(4-morpholin-4-ylphenyl)methylideneamino]carbamate
CID 2692504
N-cyclohexyl-2-[2-(4-morpholin-4-ylanilino)-2-oxoethoxy]acetamide
CID 35269451
1-cyclohexyl-3-[(5-methylfuran-2-yl)methylideneamino]urea
CID 2495861
N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]-4-(piperidin-1-ylmethyl)benzamide
CID 145127992
2-fluoro-N-[(4-morpholin-4-ylphenyl)methylideneamino]benzamide
CID 2330481
N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]thiophene-2-carboxamide
CID 6906036
6-amino-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]pyridine-3-carboxamide
CID 170647589

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea?
The IUPAC name of 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea (CID 2467512) is 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea.
What is the SMILES notation for 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea?
The canonical SMILES for 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea is O=C(NN=Cc1ccc(N2CCOCC2)cc1)NC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea?
The InChIKey is FCPLMMTWULFROT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c23-18(20-16-4-2-1-3-5-16)21-19-14-15-6-8-17(9-7-15)22-10-12-24-13-11-22/h6-9,14,16H,1-5,10-13H2,(H2,20,21,23).
What are the key properties of 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea?
1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea has a molecular weight of 330.43 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-[(4-morpholin-4-ylphenyl)methylideneamino]urea is sourced from PubChem (CID 2467512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).