1-cyclohexyl-3-(1-methoxypropan-2-yl)urea

C11H22N2O2 — CID 4169913

IUPAC1-cyclohexyl-3-(1-methoxypropan-2-yl)urea
SMILESCOCC(C)NC(=O)NC1CCCCC1
InChIInChI=1S/C11H22N2O2/c1-9(8-15-2)12-11(14)13-10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H2,12,13,14)
InChIKeyRIXRDZWCLBREIA-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.65
Rot. Bonds4

About 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea

1-cyclohexyl-3-(1-methoxypropan-2-yl)urea (PubChem CID 4169913) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea.

Molecular Properties

Compound Name1-cyclohexyl-3-(1-methoxypropan-2-yl)urea
PubChem CID4169913
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-cyclohexyl-3-(1-methoxypropan-2-yl)urea
SMILESCOCC(C)NC(=O)NC1CCCCC1
InChIInChI=1S/C11H22N2O2/c1-9(8-15-2)12-11(14)13-10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H2,12,13,14)
InChIKeyRIXRDZWCLBREIA-UHFFFAOYSA-N
XLogP1.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-N'-[3-(4-morpholinyl)propyl]urea
CID 1987766
N-Cyclohexyl-N'-(2-hydroxy-1,1-dimethylethyl)urea
CID 853713
4-(N-(Cyclohexyl)carbamoyl)morpholine
CID 853662
1-Cyclohexyl-3-(3-methoxypropyl)urea
CID 4063047
N-Cyclohexyl-N'-(2-hydroxyethyl)urea
CID 522238
Methyl 2-(3-cyclohexylureido)acetate
CID 11053022
3-Cyclohexyl-1,1-bis(2-methoxyethyl)urea
CID 75401832
N-Cyclohexyl-N'-(2-(2-hydroxyethoxy)ethyl)urea
CID 4136947
3-Cyclohexyl-1-(2-methoxyethyl)-1-nitrosourea
CID 96752
1-cyclohexyl-3-[(1R)-1-(hydroxymethyl)propyl]urea
CID 51374342
N-(2-methoxyethyl)-4-(propan-2-ylamino)piperidine-1-carboxamide
CID 72018405
1-(2-Cyanoethyl)-1-cyclohexyl-3-(2-methoxyethyl)urea
CID 172433408

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea?
The IUPAC name of 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea (CID 4169913) is 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea.
What is the SMILES notation for 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea?
The canonical SMILES for 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea is COCC(C)NC(=O)NC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea?
The InChIKey is RIXRDZWCLBREIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(8-15-2)12-11(14)13-10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3,(H2,12,13,14).
What are the key properties of 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea?
1-cyclohexyl-3-(1-methoxypropan-2-yl)urea has a molecular weight of 214.31 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(1-methoxypropan-2-yl)urea is sourced from PubChem (CID 4169913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).