1-ethenoxyethylurea

C5H10N2O2 — CID 19078685

IUPAC1-ethenoxyethylurea
SMILESC=COC(C)NC(N)=O
InChIInChI=1S/C5H10N2O2/c1-3-9-4(2)7-5(6)8/h3-4H,1H2,2H3,(H3,6,7,8)
InChIKeyZCXZBPRJLPXFPW-UHFFFAOYSA-N
MW130.15 g/mol
LogP0.16
Rot. Bonds3

About 1-ethenoxyethylurea

1-ethenoxyethylurea (PubChem CID 19078685) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 1-ethenoxyethylurea.

Molecular Properties

Compound Name1-ethenoxyethylurea
PubChem CID19078685
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name1-ethenoxyethylurea
SMILESC=COC(C)NC(N)=O
InChIInChI=1S/C5H10N2O2/c1-3-9-4(2)7-5(6)8/h3-4H,1H2,2H3,(H3,6,7,8)
InChIKeyZCXZBPRJLPXFPW-UHFFFAOYSA-N
XLogP0.16
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(carbamoylamino)ethyl prop-2-enoate
CID 22146186
copper(1+);N-(1-ethenoxyethyl)carbamodithioate
CID 21156188
(4-ethenoxy-2-methylpentan-2-yl)urea
CID 154135773
1-(nitrosomethoxy)ethylurea
CID 21121231
[1-(carbamoylamino)-2-methylpropyl]urea
CID 22478
N-ethenoxy-2-methylpropanamide
CID 174437666
3-ethenoxy-2-methyl-3-oxopropanoic acid
CID 139933111
1-(carbamoylamino)propyl prop-2-enoate
CID 87391559
methyl (2Z)-3-amino-4-methylhexa-2,5-dienoate
CID 15857172
2-[[2-(carbamoylamino)-3-methylpentanoyl]-prop-2-enylamino]acetic acid
CID 79263277
2-(carbamoylamino)-3-methyl-N-prop-2-enylbutanamide
CID 60636446
2-ethenoxybutanedioic acid
CID 139665249

Frequently Asked Questions

What is the IUPAC name of 1-ethenoxyethylurea?
The IUPAC name of 1-ethenoxyethylurea (CID 19078685) is 1-ethenoxyethylurea.
What is the SMILES notation for 1-ethenoxyethylurea?
The canonical SMILES for 1-ethenoxyethylurea is C=COC(C)NC(N)=O.
What is the InChIKey of 1-ethenoxyethylurea?
The InChIKey is ZCXZBPRJLPXFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-3-9-4(2)7-5(6)8/h3-4H,1H2,2H3,(H3,6,7,8).
What are the key properties of 1-ethenoxyethylurea?
1-ethenoxyethylurea has a molecular weight of 130.15 g/mol, XLogP of 0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenoxyethylurea is sourced from PubChem (CID 19078685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).