3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea

C14H22N2O3 — CID 71804033

IUPAC3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea
SMILESCOCCN(Cc1ccoc1)C(=O)NC1CCCC1
InChIInChI=1S/C14H22N2O3/c1-18-9-7-16(10-12-6-8-19-11-12)14(17)15-13-4-2-3-5-13/h6,8,11,13H,2-5,7,9-10H2,1H3,(H,15,17)
InChIKeyVYSAYOUGGNEJLB-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.38
Rot. Bonds6

About 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea

3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea (PubChem CID 71804033) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea.

Molecular Properties

Compound Name3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea
PubChem CID71804033
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea
SMILESCOCCN(Cc1ccoc1)C(=O)NC1CCCC1
InChIInChI=1S/C14H22N2O3/c1-18-9-7-16(10-12-6-8-19-11-12)14(17)15-13-4-2-3-5-13/h6,8,11,13H,2-5,7,9-10H2,1H3,(H,15,17)
InChIKeyVYSAYOUGGNEJLB-UHFFFAOYSA-N
XLogP2.38
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea?
The IUPAC name of 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea (CID 71804033) is 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea.
What is the SMILES notation for 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea?
The canonical SMILES for 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea is COCCN(Cc1ccoc1)C(=O)NC1CCCC1.
What is the InChIKey of 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea?
The InChIKey is VYSAYOUGGNEJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-18-9-7-16(10-12-6-8-19-11-12)14(17)15-13-4-2-3-5-13/h6,8,11,13H,2-5,7,9-10H2,1H3,(H,15,17).
What are the key properties of 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea?
3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea has a molecular weight of 266.34 g/mol, XLogP of 2.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(furan-3-ylmethyl)-1-(2-methoxyethyl)urea is sourced from PubChem (CID 71804033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).