1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea

C10H22N2O2 — CID 103708339

IUPAC1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea
SMILESCCCC(CCO)CNC(=O)NCC
InChIInChI=1S/C10H22N2O2/c1-3-5-9(6-7-13)8-12-10(14)11-4-2/h9,13H,3-8H2,1-2H3,(H2,11,12,14)
InChIKeyJYMQDSCPLMPXEW-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.10
Rot. Bonds7

About 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea

1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea (PubChem CID 103708339) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea.

Molecular Properties

Compound Name1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea
PubChem CID103708339
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea
SMILESCCCC(CCO)CNC(=O)NCC
InChIInChI=1S/C10H22N2O2/c1-3-5-9(6-7-13)8-12-10(14)11-4-2/h9,13H,3-8H2,1-2H3,(H2,11,12,14)
InChIKeyJYMQDSCPLMPXEW-UHFFFAOYSA-N
XLogP1.10
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2-hydroxyethyl)pentyl]-3-[(1-methylcyclopentyl)methyl]urea
CID 111506160
N-[2-(2-hydroxyethyl)pentyl]prop-2-ynamide
CID 103846773
2-(ethylamino)-N-[2-(2-hydroxyethyl)pentyl]-2-methylpropanamide
CID 114145534
4-[[2-(2-hydroxyethyl)pentylcarbamoylamino]methyl]benzoic acid
CID 122020996
2-bromo-N-[2-(2-hydroxyethyl)pentyl]-2-methylpropanamide
CID 106114985
N-[2-(2-hydroxyethyl)pentyl]-2-methylsulfanylacetamide
CID 103722907
N-[2-(2-hydroxyethyl)pentyl]-2-(methylamino)acetamide;hydrochloride
CID 120704813
1-(4-chlorophenyl)-3-[2-(2-hydroxyethyl)pentyl]urea
CID 103709965
1-(3,5-dichlorophenyl)-3-[2-(2-hydroxyethyl)pentyl]urea
CID 103709984
3,3,3-trifluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide
CID 103725598
1-(4-acetylphenyl)-3-[2-(2-hydroxyethyl)pentyl]urea
CID 103709881
1-[2-(2-hydroxyethyl)-4-methylpentyl]-3-(2-methylpropyl)urea
CID 111503800

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea?
The IUPAC name of 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea (CID 103708339) is 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea.
What is the SMILES notation for 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea?
The canonical SMILES for 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea is CCCC(CCO)CNC(=O)NCC.
What is the InChIKey of 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea?
The InChIKey is JYMQDSCPLMPXEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-3-5-9(6-7-13)8-12-10(14)11-4-2/h9,13H,3-8H2,1-2H3,(H2,11,12,14).
What are the key properties of 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea?
1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea has a molecular weight of 202.30 g/mol, XLogP of 1.10, 7 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[2-(2-hydroxyethyl)pentyl]urea is sourced from PubChem (CID 103708339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).