1-(cyclohexylmethyl)-3-ethylurea

C10H20N2O — CID 43835934

IUPAC1-(cyclohexylmethyl)-3-ethylurea
SMILESCCNC(=O)NCC1CCCCC1
InChIInChI=1S/C10H20N2O/c1-2-11-10(13)12-8-9-6-4-3-5-7-9/h9H,2-8H2,1H3,(H2,11,12,13)
InChIKeyXYMJAHRZIMXZRT-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.89
Rot. Bonds3

About 1-(cyclohexylmethyl)-3-ethylurea

1-(cyclohexylmethyl)-3-ethylurea (PubChem CID 43835934) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)-3-ethylurea.

Molecular Properties

Compound Name1-(cyclohexylmethyl)-3-ethylurea
PubChem CID43835934
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(cyclohexylmethyl)-3-ethylurea
SMILESCCNC(=O)NCC1CCCCC1
InChIInChI=1S/C10H20N2O/c1-2-11-10(13)12-8-9-6-4-3-5-7-9/h9H,2-8H2,1H3,(H2,11,12,13)
InChIKeyXYMJAHRZIMXZRT-UHFFFAOYSA-N
XLogP1.89
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)-3-ethylurea?
The IUPAC name of 1-(cyclohexylmethyl)-3-ethylurea (CID 43835934) is 1-(cyclohexylmethyl)-3-ethylurea.
What is the SMILES notation for 1-(cyclohexylmethyl)-3-ethylurea?
The canonical SMILES for 1-(cyclohexylmethyl)-3-ethylurea is CCNC(=O)NCC1CCCCC1.
What is the InChIKey of 1-(cyclohexylmethyl)-3-ethylurea?
The InChIKey is XYMJAHRZIMXZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-11-10(13)12-8-9-6-4-3-5-7-9/h9H,2-8H2,1H3,(H2,11,12,13).
What are the key properties of 1-(cyclohexylmethyl)-3-ethylurea?
1-(cyclohexylmethyl)-3-ethylurea has a molecular weight of 184.28 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)-3-ethylurea is sourced from PubChem (CID 43835934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).