1-(2,3-dimethylcyclopentyl)-3-ethylurea

C10H20N2O — CID 116656362

IUPAC1-(2,3-dimethylcyclopentyl)-3-ethylurea
SMILESCCNC(=O)NC1CCC(C)C1C
InChIInChI=1S/C10H20N2O/c1-4-11-10(13)12-9-6-5-7(2)8(9)3/h7-9H,4-6H2,1-3H3,(H2,11,12,13)
InChIKeyRFGUSSZWJNOGAF-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.74
Rot. Bonds2

About 1-(2,3-dimethylcyclopentyl)-3-ethylurea

1-(2,3-dimethylcyclopentyl)-3-ethylurea (PubChem CID 116656362) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(2,3-dimethylcyclopentyl)-3-ethylurea.

Molecular Properties

Compound Name1-(2,3-dimethylcyclopentyl)-3-ethylurea
PubChem CID116656362
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-(2,3-dimethylcyclopentyl)-3-ethylurea
SMILESCCNC(=O)NC1CCC(C)C1C
InChIInChI=1S/C10H20N2O/c1-4-11-10(13)12-9-6-5-7(2)8(9)3/h7-9H,4-6H2,1-3H3,(H2,11,12,13)
InChIKeyRFGUSSZWJNOGAF-UHFFFAOYSA-N
XLogP1.74
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

Ethylhexyl cyclohexyl urea
CID 4657034
3-(2-Butylcyclopentyl)-1-ethyl-1-methylurea
CID 56801089
1-(cyclopentylmethyl)-3-[(1S)-1-cyclopropylethyl]urea
CID 96471073
1-Methyl-3-(3-propan-2-ylcyclopentyl)-1-(2,2,2-trifluoroethyl)urea
CID 58395206
3-(3-Ethylcyclopentyl)-1-methyl-1-(2,2,2-trifluoroethyl)urea
CID 68260685
1-(2-Fluoroethyl)-3-(3-methylcyclopentyl)urea
CID 89139721
1-(2,3-Dimethylcyclopentyl)-3-(2-fluoroethyl)urea
CID 89139725
1-[(2-Methylcyclopentyl)methyl]-3-(2,2,2-trifluoroethyl)urea
CID 107417732
1-(1-Cyclopentylethyl)-3-(2,2,2-trifluoroethyl)urea
CID 115626647
1-(2,3-Dimethylcyclopentyl)-3-(2,2,2-trifluoroethyl)urea
CID 116656372
1-(3-Ethyl-2-methylcyclopentyl)-3-(2,2,2-trifluoroethyl)urea
CID 116656393
1-(2-Fluoroethyl)-3-(2-methylcyclopentyl)urea
CID 130702964

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylcyclopentyl)-3-ethylurea?
The IUPAC name of 1-(2,3-dimethylcyclopentyl)-3-ethylurea (CID 116656362) is 1-(2,3-dimethylcyclopentyl)-3-ethylurea.
What is the SMILES notation for 1-(2,3-dimethylcyclopentyl)-3-ethylurea?
The canonical SMILES for 1-(2,3-dimethylcyclopentyl)-3-ethylurea is CCNC(=O)NC1CCC(C)C1C.
What is the InChIKey of 1-(2,3-dimethylcyclopentyl)-3-ethylurea?
The InChIKey is RFGUSSZWJNOGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-11-10(13)12-9-6-5-7(2)8(9)3/h7-9H,4-6H2,1-3H3,(H2,11,12,13).
What are the key properties of 1-(2,3-dimethylcyclopentyl)-3-ethylurea?
1-(2,3-dimethylcyclopentyl)-3-ethylurea has a molecular weight of 184.28 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylcyclopentyl)-3-ethylurea is sourced from PubChem (CID 116656362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).