1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea

C11H22N2O3 — CID 108909976

IUPAC1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea
SMILESCOCCN(CCOC)C(=O)NC=C(C)C
InChIInChI=1S/C11H22N2O3/c1-10(2)9-12-11(14)13(5-7-15-3)6-8-16-4/h9H,5-8H2,1-4H3,(H,12,14)
InChIKeyMELVDYHHHUMEKU-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.21
Rot. Bonds7

About 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea

1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea (PubChem CID 108909976) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea.

Molecular Properties

Compound Name1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea
PubChem CID108909976
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea
SMILESCOCCN(CCOC)C(=O)NC=C(C)C
InChIInChI=1S/C11H22N2O3/c1-10(2)9-12-11(14)13(5-7-15-3)6-8-16-4/h9H,5-8H2,1-4H3,(H,12,14)
InChIKeyMELVDYHHHUMEKU-UHFFFAOYSA-N
XLogP1.21
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Cycloheptylidenemethyl)-1-(2-methoxyethyl)-1-propylurea
CID 123272661
1,3-Bis[2-(2-methylprop-1-enoxy)ethyl]urea
CID 151388958
3-Ethyl-1-(2-methoxyethyl)-1-prop-2-enylurea
CID 103338592
1-(2-Methoxyethyl)-3-methyl-1-prop-2-enylurea
CID 103338599
3-(2-Methoxyethyl)-1,1-bis(prop-2-enyl)urea
CID 108890517
3-Ethenyl-1,1-bis(2-methoxyethyl)urea
CID 108909235
1,1-bis(2-methoxyethyl)-3-[(E)-prop-1-enyl]urea
CID 108909605
2,6-dimethyl-N-(2-methylprop-1-enyl)morpholine-4-carboxamide
CID 108909796
1-(2-Methoxyethyl)-3-(2-methylprop-1-enyl)urea
CID 108909803
1-(3-Methoxypropyl)-3-(2-methylprop-1-enyl)urea
CID 108909811
N-(2-methylprop-1-enyl)morpholine-4-carboxamide
CID 108909830
1,1-Bis(2-hydroxyethyl)-3-(2-methylprop-1-enyl)urea
CID 108909832

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea?
The IUPAC name of 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea (CID 108909976) is 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea.
What is the SMILES notation for 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea?
The canonical SMILES for 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea is COCCN(CCOC)C(=O)NC=C(C)C.
What is the InChIKey of 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea?
The InChIKey is MELVDYHHHUMEKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-10(2)9-12-11(14)13(5-7-15-3)6-8-16-4/h9H,5-8H2,1-4H3,(H,12,14).
What are the key properties of 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea?
1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea has a molecular weight of 230.31 g/mol, XLogP of 1.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(2-methoxyethyl)-3-(2-methylprop-1-enyl)urea is sourced from PubChem (CID 108909976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).