1-methyl-3-[(Z)-prop-1-enyl]urea

C5H10N2O — CID 177150364

IUPAC1-methyl-3-[(Z)-prop-1-enyl]urea
SMILESC/C=C\NC(=O)NC
InChIInChI=1S/C5H10N2O/c1-3-4-7-5(8)6-2/h3-4H,1-2H3,(H2,6,7,8)/b4-3-
InChIKeyRYFRHCAQHHXJIR-ARJAWSKDSA-N
MW114.15 g/mol
LogP0.45
Rot. Bonds1

About 1-methyl-3-[(Z)-prop-1-enyl]urea

1-methyl-3-[(Z)-prop-1-enyl]urea (PubChem CID 177150364) has the molecular formula C5H10N2O and a molecular weight of 114.15 g/mol. Its IUPAC name is 1-methyl-3-[(Z)-prop-1-enyl]urea.

Molecular Properties

Compound Name1-methyl-3-[(Z)-prop-1-enyl]urea
PubChem CID177150364
Molecular FormulaC5H10N2O
Molecular Weight114.15 g/mol
Exact Mass114.08
IUPAC Name1-methyl-3-[(Z)-prop-1-enyl]urea
SMILESC/C=C\NC(=O)NC
InChIInChI=1S/C5H10N2O/c1-3-4-7-5(8)6-2/h3-4H,1-2H3,(H2,6,7,8)/b4-3-
InChIKeyRYFRHCAQHHXJIR-ARJAWSKDSA-N
XLogP0.45
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1,1-dimethyl-3-[(E)-prop-1-enyl]urea
CID 11819097
Methylenbismethylharnstoff
CID 18417868
2,3-Dihydro-1h-1,3-diazepin-2-one
CID 21579051
Dimethylvinylurea
CID 21719024
N,N'-Diethenylurea
CID 22486539
N-methyldihydro-2-pyrimidinone
CID 23121765
3-Butenyl-harnstoff
CID 53406735
Propenyl urea
CID 54130800
Ethyl 3,4-dihydropyrimidinone
CID 67592206
1,1,3-trimethyl-3-[(E)-prop-1-enyl]urea
CID 90473859
1-[(1E,3Z)-5-fluoropenta-1,3-dienyl]-3-methylurea
CID 135276370
1-[(E)-2-cyanoethenyl]-3-methylurea
CID 14730410

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[(Z)-prop-1-enyl]urea?
The IUPAC name of 1-methyl-3-[(Z)-prop-1-enyl]urea (CID 177150364) is 1-methyl-3-[(Z)-prop-1-enyl]urea.
What is the SMILES notation for 1-methyl-3-[(Z)-prop-1-enyl]urea?
The canonical SMILES for 1-methyl-3-[(Z)-prop-1-enyl]urea is C/C=C\NC(=O)NC.
What is the InChIKey of 1-methyl-3-[(Z)-prop-1-enyl]urea?
The InChIKey is RYFRHCAQHHXJIR-ARJAWSKDSA-N. The full InChI is InChI=1S/C5H10N2O/c1-3-4-7-5(8)6-2/h3-4H,1-2H3,(H2,6,7,8)/b4-3-.
What are the key properties of 1-methyl-3-[(Z)-prop-1-enyl]urea?
1-methyl-3-[(Z)-prop-1-enyl]urea has a molecular weight of 114.15 g/mol, XLogP of 0.45, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(Z)-prop-1-enyl]urea is sourced from PubChem (CID 177150364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).