1-cyclopentyl-1,3-diethylurea

C10H20N2O — CID 66860832

IUPAC1-cyclopentyl-1,3-diethylurea
SMILESCCNC(=O)N(CC)C1CCCC1
InChIInChI=1S/C10H20N2O/c1-3-11-10(13)12(4-2)9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyDSGIEKWBDOSACI-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.98
Rot. Bonds3

About 1-cyclopentyl-1,3-diethylurea

1-cyclopentyl-1,3-diethylurea (PubChem CID 66860832) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-cyclopentyl-1,3-diethylurea.

Molecular Properties

Compound Name1-cyclopentyl-1,3-diethylurea
PubChem CID66860832
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-cyclopentyl-1,3-diethylurea
SMILESCCNC(=O)N(CC)C1CCCC1
InChIInChI=1S/C10H20N2O/c1-3-11-10(13)12(4-2)9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyDSGIEKWBDOSACI-UHFFFAOYSA-N
XLogP1.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-1,3-diethylurea?
The IUPAC name of 1-cyclopentyl-1,3-diethylurea (CID 66860832) is 1-cyclopentyl-1,3-diethylurea.
What is the SMILES notation for 1-cyclopentyl-1,3-diethylurea?
The canonical SMILES for 1-cyclopentyl-1,3-diethylurea is CCNC(=O)N(CC)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-1,3-diethylurea?
The InChIKey is DSGIEKWBDOSACI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-11-10(13)12(4-2)9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of 1-cyclopentyl-1,3-diethylurea?
1-cyclopentyl-1,3-diethylurea has a molecular weight of 184.28 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-1,3-diethylurea is sourced from PubChem (CID 66860832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).