1-(cyclohexylmethyl)-3-methylurea;ethane

C11H24N2O — CID 143985517

IUPAC1-(cyclohexylmethyl)-3-methylurea;ethane
SMILESCC.CNC(=O)NCC1CCCCC1
InChIInChI=1S/C9H18N2O.C2H6/c1-10-9(12)11-7-8-5-3-2-4-6-8;1-2/h8H,2-7H2,1H3,(H2,10,11,12);1-2H3
InChIKeyPAEOGBQWQOJASZ-UHFFFAOYSA-N
MW200.33 g/mol
LogP2.52
Rot. Bonds2

About 1-(cyclohexylmethyl)-3-methylurea;ethane

1-(cyclohexylmethyl)-3-methylurea;ethane (PubChem CID 143985517) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)-3-methylurea;ethane.

Molecular Properties

Compound Name1-(cyclohexylmethyl)-3-methylurea;ethane
PubChem CID143985517
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-(cyclohexylmethyl)-3-methylurea;ethane
SMILESCC.CNC(=O)NCC1CCCCC1
InChIInChI=1S/C9H18N2O.C2H6/c1-10-9(12)11-7-8-5-3-2-4-6-8;1-2/h8H,2-7H2,1H3,(H2,10,11,12);1-2H3
InChIKeyPAEOGBQWQOJASZ-UHFFFAOYSA-N
XLogP2.52
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-(cyclohexylmethyl)-3-methylurea;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)-3-methylurea;ethane?
The IUPAC name of 1-(cyclohexylmethyl)-3-methylurea;ethane (CID 143985517) is 1-(cyclohexylmethyl)-3-methylurea;ethane.
What is the SMILES notation for 1-(cyclohexylmethyl)-3-methylurea;ethane?
The canonical SMILES for 1-(cyclohexylmethyl)-3-methylurea;ethane is CC.CNC(=O)NCC1CCCCC1.
What is the InChIKey of 1-(cyclohexylmethyl)-3-methylurea;ethane?
The InChIKey is PAEOGBQWQOJASZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O.C2H6/c1-10-9(12)11-7-8-5-3-2-4-6-8;1-2/h8H,2-7H2,1H3,(H2,10,11,12);1-2H3.
What are the key properties of 1-(cyclohexylmethyl)-3-methylurea;ethane?
1-(cyclohexylmethyl)-3-methylurea;ethane has a molecular weight of 200.33 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)-3-methylurea;ethane is sourced from PubChem (CID 143985517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).