1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea

C11H23N3O — CID 115604545

IUPAC1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea
SMILESCCN1CCCC(NC(=O)N(C)CC)C1
InChIInChI=1S/C11H23N3O/c1-4-13(3)11(15)12-10-7-6-8-14(5-2)9-10/h10H,4-9H2,1-3H3,(H,12,15)
InChIKeyLZLUBMZRYQTUBK-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.13
Rot. Bonds3

About 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea

1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea (PubChem CID 115604545) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea.

Molecular Properties

Compound Name1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea
PubChem CID115604545
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea
SMILESCCN1CCCC(NC(=O)N(C)CC)C1
InChIInChI=1S/C11H23N3O/c1-4-13(3)11(15)12-10-7-6-8-14(5-2)9-10/h10H,4-9H2,1-3H3,(H,12,15)
InChIKeyLZLUBMZRYQTUBK-UHFFFAOYSA-N
XLogP1.13
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589989
1-cyclopropyl-3-(1-ethylpiperidin-3-yl)urea
CID 115589816
tert-butyl 3-[[ethyl(methyl)carbamoyl]amino]piperidine-1-carboxylate
CID 126812951
3-[(1-ethylpiperidin-3-yl)carbamoyl-propan-2-ylamino]propanoic acid
CID 61478465
2-bromo-N-(1-ethylpiperidin-3-yl)propanamide
CID 107904785
3-[(3S)-1-ethylpiperidin-3-yl]-1-methyl-1-[(3-methylsulfanylphenyl)methyl]urea
CID 125437297
3-[(3R)-1-ethylpiperidin-3-yl]-1-methyl-1-[(3-methylsulfanylphenyl)methyl]urea
CID 125437298
2-bromo-N-(1-ethylpiperidin-3-yl)butanamide
CID 62854187
2-hydroxyethyl N-(1-ethylpiperidin-3-yl)carbamate
CID 79348890
3-amino-N-(1-ethylpiperidin-3-yl)-3-methylbutanamide
CID 64677785
2-cyano-N-(1-ethylpiperidin-3-yl)propanamide
CID 55208553
2-amino-N-(1-ethylpiperidin-3-yl)-4-methoxybutanamide
CID 55080821

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea?
The IUPAC name of 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea (CID 115604545) is 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea.
What is the SMILES notation for 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea?
The canonical SMILES for 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea is CCN1CCCC(NC(=O)N(C)CC)C1.
What is the InChIKey of 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea?
The InChIKey is LZLUBMZRYQTUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-4-13(3)11(15)12-10-7-6-8-14(5-2)9-10/h10H,4-9H2,1-3H3,(H,12,15).
What are the key properties of 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea?
1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea has a molecular weight of 213.32 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(1-ethylpiperidin-3-yl)-1-methylurea is sourced from PubChem (CID 115604545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).