3-cyclopentyl-1,1-diethylurea

C10H20N2O — CID 3640751

IUPAC3-cyclopentyl-1,1-diethylurea
SMILESCCN(CC)C(=O)NC1CCCC1
InChIInChI=1S/C10H20N2O/c1-3-12(4-2)10(13)11-9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyHMXLKYUPEMJOGC-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.98
Rot. Bonds3

About 3-cyclopentyl-1,1-diethylurea

3-cyclopentyl-1,1-diethylurea (PubChem CID 3640751) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-cyclopentyl-1,1-diethylurea.

Molecular Properties

Compound Name3-cyclopentyl-1,1-diethylurea
PubChem CID3640751
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-cyclopentyl-1,1-diethylurea
SMILESCCN(CC)C(=O)NC1CCCC1
InChIInChI=1S/C10H20N2O/c1-3-12(4-2)10(13)11-9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,11,13)
InChIKeyHMXLKYUPEMJOGC-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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Related Compounds

1-Cyclohexyl-3-methylurea
CID 308344
Cyclopentylurea
CID 294526
N-(Sec-butyl)-N'-cyclohexylurea
CID 4417023
1-Cyclohexyl-3-hexyl urea
CID 5151394
N-cyclohexyl-1-pyrrolidinecarboxamide
CID 327479
Urea, 1,1-dibutyl-3-ethyl-
CID 3040358
1-Cyclohexyl-3-isopropylurea
CID 280348
1-Butyl-3-cyclohexylurea
CID 3613676
Urea, N'-cyclohexyl-N,N-dimethyl-
CID 4594662
1-Cyclohexyl-3-ethylurea
CID 5151398
1-Cyclohexyl-3-propylurea
CID 280347
N-[2-(diethylamino)ethyl](cyclohexylamino)carboxamide
CID 2054543

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1,1-diethylurea?
The IUPAC name of 3-cyclopentyl-1,1-diethylurea (CID 3640751) is 3-cyclopentyl-1,1-diethylurea.
What is the SMILES notation for 3-cyclopentyl-1,1-diethylurea?
The canonical SMILES for 3-cyclopentyl-1,1-diethylurea is CCN(CC)C(=O)NC1CCCC1.
What is the InChIKey of 3-cyclopentyl-1,1-diethylurea?
The InChIKey is HMXLKYUPEMJOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-12(4-2)10(13)11-9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,11,13).
What are the key properties of 3-cyclopentyl-1,1-diethylurea?
3-cyclopentyl-1,1-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 3-cyclopentyl-1,1-diethylurea is sourced from PubChem (CID 3640751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).