1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride

C17H26ClN3O2 — CID 67239601

IUPAC1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride
SMILESCl.O=C(Nc1ccc(C2CNCCO2)cc1)NC1CCCCC1
InChIInChI=1S/C17H25N3O2.ClH/c21-17(19-14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)16-12-18-10-11-22-16;/h6-9,14,16,18H,1-5,10-12H2,(H2,19,20,21);1H
InChIKeyDYMBJQNZECKPHS-UHFFFAOYSA-N
MW339.87 g/mol
LogP3.22
Rot. Bonds3

About 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride

1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride (PubChem CID 67239601) has the molecular formula C17H26ClN3O2 and a molecular weight of 339.87 g/mol. Its IUPAC name is 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride
PubChem CID67239601
Molecular FormulaC17H26ClN3O2
Molecular Weight339.87 g/mol
Exact Mass339.17
IUPAC Name1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride
SMILESCl.O=C(Nc1ccc(C2CNCCO2)cc1)NC1CCCCC1
InChIInChI=1S/C17H25N3O2.ClH/c21-17(19-14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)16-12-18-10-11-22-16;/h6-9,14,16,18H,1-5,10-12H2,(H2,19,20,21);1H
InChIKeyDYMBJQNZECKPHS-UHFFFAOYSA-N
XLogP3.22
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.87
LogP ≤ 53.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-chlorophenyl)-3-(4-morpholin-2-ylphenyl)urea;hydrochloride
CID 67241922
1-cyclohexyl-3-(4-cyclopentylphenyl)urea
CID 170179753
1-(6-chloro-2-pyridinyl)-3-(4-morpholin-2-ylphenyl)urea;hydrochloride
CID 87325728
1-(4-bromophenyl)-3-cycloheptylurea
CID 47132836
4-methoxy-N-(4-morpholin-2-ylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 67238948
tert-butyl N-(4-morpholin-2-ylphenyl)carbamate
CID 117446363
1-cyclohexyl-3-[4-(cyclohexylamino)phenyl]urea
CID 112980754
2,6-dichloro-N-[4-[(2R)-morpholin-2-yl]phenyl]benzamide
CID 129387150
4-methoxy-N-(4-morpholin-2-ylphenyl)benzamide;hydrochloride
CID 67239468
4-formyl-N-(4-morpholin-2-ylphenyl)benzamide
CID 86673956
1-(4-chlorophenyl)-3-cyclododecylurea
CID 19165021
N-[4-[(2S)-morpholin-2-yl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 56836053

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride?
The IUPAC name of 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride (CID 67239601) is 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride?
The canonical SMILES for 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride is Cl.O=C(Nc1ccc(C2CNCCO2)cc1)NC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride?
The InChIKey is DYMBJQNZECKPHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2.ClH/c21-17(19-14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)16-12-18-10-11-22-16;/h6-9,14,16,18H,1-5,10-12H2,(H2,19,20,21);1H.
What are the key properties of 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride?
1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride has a molecular weight of 339.87 g/mol, XLogP of 3.22, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(4-morpholin-2-ylphenyl)urea;hydrochloride is sourced from PubChem (CID 67239601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).