1-(1-ethylcyclopentyl)-3-propylurea

C11H22N2O — CID 130216551

IUPAC1-(1-ethylcyclopentyl)-3-propylurea
SMILESCCCNC(=O)NC1(CC)CCCC1
InChIInChI=1S/C11H22N2O/c1-3-9-12-10(14)13-11(4-2)7-5-6-8-11/h3-9H2,1-2H3,(H2,12,13,14)
InChIKeyWJZPNLJPQKZJLR-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.42
Rot. Bonds4

About 1-(1-ethylcyclopentyl)-3-propylurea

1-(1-ethylcyclopentyl)-3-propylurea (PubChem CID 130216551) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(1-ethylcyclopentyl)-3-propylurea.

Molecular Properties

Compound Name1-(1-ethylcyclopentyl)-3-propylurea
PubChem CID130216551
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(1-ethylcyclopentyl)-3-propylurea
SMILESCCCNC(=O)NC1(CC)CCCC1
InChIInChI=1S/C11H22N2O/c1-3-9-12-10(14)13-11(4-2)7-5-6-8-11/h3-9H2,1-2H3,(H2,12,13,14)
InChIKeyWJZPNLJPQKZJLR-UHFFFAOYSA-N
XLogP2.42
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylcyclopentyl)-3-propylurea?
The IUPAC name of 1-(1-ethylcyclopentyl)-3-propylurea (CID 130216551) is 1-(1-ethylcyclopentyl)-3-propylurea.
What is the SMILES notation for 1-(1-ethylcyclopentyl)-3-propylurea?
The canonical SMILES for 1-(1-ethylcyclopentyl)-3-propylurea is CCCNC(=O)NC1(CC)CCCC1.
What is the InChIKey of 1-(1-ethylcyclopentyl)-3-propylurea?
The InChIKey is WJZPNLJPQKZJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-9-12-10(14)13-11(4-2)7-5-6-8-11/h3-9H2,1-2H3,(H2,12,13,14).
What are the key properties of 1-(1-ethylcyclopentyl)-3-propylurea?
1-(1-ethylcyclopentyl)-3-propylurea has a molecular weight of 198.31 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylcyclopentyl)-3-propylurea is sourced from PubChem (CID 130216551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).