1-(1-methylpiperidin-4-yl)ethylurea

C9H19N3O — CID 126990260

IUPAC1-(1-methylpiperidin-4-yl)ethylurea
SMILESCC(NC(N)=O)C1CCN(C)CC1
InChIInChI=1S/C9H19N3O/c1-7(11-9(10)13)8-3-5-12(2)6-4-8/h7-8H,3-6H2,1-2H3,(H3,10,11,13)
InChIKeySDKUFUSAGPJBBM-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.38
Rot. Bonds2

About 1-(1-methylpiperidin-4-yl)ethylurea

1-(1-methylpiperidin-4-yl)ethylurea (PubChem CID 126990260) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(1-methylpiperidin-4-yl)ethylurea.

Molecular Properties

Compound Name1-(1-methylpiperidin-4-yl)ethylurea
PubChem CID126990260
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name1-(1-methylpiperidin-4-yl)ethylurea
SMILESCC(NC(N)=O)C1CCN(C)CC1
InChIInChI=1S/C9H19N3O/c1-7(11-9(10)13)8-3-5-12(2)6-4-8/h7-8H,3-6H2,1-2H3,(H3,10,11,13)
InChIKeySDKUFUSAGPJBBM-UHFFFAOYSA-N
XLogP0.38
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(1-methylpiperidin-4-yl)ethyl]hydroxylamine
CID 59870766
3,5-dimethyl-N-[(1R)-1-(1-methylpiperidin-4-yl)ethyl]imidazole-4-carboxamide
CID 125448591
2-(4-cyclopentylpiperidin-1-yl)-N-[1-(1-methylpiperidin-4-yl)ethyl]-2-oxoacetamide
CID 154859661
ethyl 2-[1-(1-methylpiperidin-4-yl)ethylamino]acetate
CID 60811226
2-methyl-1-[4-[1-(1-methylpiperidin-4-yl)ethylamino]piperidin-1-yl]propan-1-one
CID 43747768
2-methyl-N-[2-[1-(1-methylpiperidin-4-yl)ethylamino]ethyl]propanamide
CID 43308231
N'-[1-(1-methylpiperidin-4-yl)ethyl]propane-1,3-diamine
CID 60890086
2-methyl-3-[1-(1-methylpiperidin-4-yl)ethylamino]benzamide
CID 43694021
3-amino-2-methyl-3-(1-methylpiperidin-4-yl)propanoic acid
CID 116938112
2-[1-(1-methylpiperidin-4-yl)ethylamino]ethanol
CID 43308736
2-methyl-3-[1-(1-methylpiperidin-4-yl)ethylamino]propane-1,2-diol
CID 66169642
2-methyl-N-[1-(1-methylpiperidin-4-yl)ethyl]propan-1-amine
CID 43307393

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpiperidin-4-yl)ethylurea?
The IUPAC name of 1-(1-methylpiperidin-4-yl)ethylurea (CID 126990260) is 1-(1-methylpiperidin-4-yl)ethylurea.
What is the SMILES notation for 1-(1-methylpiperidin-4-yl)ethylurea?
The canonical SMILES for 1-(1-methylpiperidin-4-yl)ethylurea is CC(NC(N)=O)C1CCN(C)CC1.
What is the InChIKey of 1-(1-methylpiperidin-4-yl)ethylurea?
The InChIKey is SDKUFUSAGPJBBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-7(11-9(10)13)8-3-5-12(2)6-4-8/h7-8H,3-6H2,1-2H3,(H3,10,11,13).
What are the key properties of 1-(1-methylpiperidin-4-yl)ethylurea?
1-(1-methylpiperidin-4-yl)ethylurea has a molecular weight of 185.27 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpiperidin-4-yl)ethylurea is sourced from PubChem (CID 126990260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).