1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea

C19H28N4O3 — CID 46038614

IUPAC1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea
SMILESCCNC(=O)NC1CCN(c2ccccc2C(=O)N2CCOCC2)CC1
InChIInChI=1S/C19H28N4O3/c1-2-20-19(25)21-15-7-9-22(10-8-15)17-6-4-3-5-16(17)18(24)23-11-13-26-14-12-23/h3-6,15H,2,7-14H2,1H3,(H2,20,21,25)
InChIKeyLDNJUMULBWHEDG-UHFFFAOYSA-N
MW360.46 g/mol
LogP1.45
Rot. Bonds4

About 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea

1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea (PubChem CID 46038614) has the molecular formula C19H28N4O3 and a molecular weight of 360.46 g/mol. Its IUPAC name is 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea.

Molecular Properties

Compound Name1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea
PubChem CID46038614
Molecular FormulaC19H28N4O3
Molecular Weight360.46 g/mol
Exact Mass360.22
IUPAC Name1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea
SMILESCCNC(=O)NC1CCN(c2ccccc2C(=O)N2CCOCC2)CC1
InChIInChI=1S/C19H28N4O3/c1-2-20-19(25)21-15-7-9-22(10-8-15)17-6-4-3-5-16(17)18(24)23-11-13-26-14-12-23/h3-6,15H,2,7-14H2,1H3,(H2,20,21,25)
InChIKeyLDNJUMULBWHEDG-UHFFFAOYSA-N
XLogP1.45
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]-3-prop-2-enylurea
CID 46038618
N-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]-3-phenylpropanamide
CID 46037987
N-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]-2-phenoxyacetamide
CID 46038010
2-[4-(ethylcarbamoylamino)piperidin-1-yl]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 93324275
2-[4-(ethylcarbamoylamino)piperidin-1-yl]-N-(oxolan-2-ylmethyl)benzamide
CID 46038581
N-[1-[2-[4-(2-chlorophenyl)piperazine-1-carbonyl]phenyl]piperidin-4-yl]acetamide
CID 42848348
2-methyl-N-[1-[2-(piperidine-1-carbonyl)phenyl]piperidin-4-yl]benzamide
CID 46038031
4-ethyl-N-[1-[2-(4-methylpiperidine-1-carbonyl)phenyl]piperidin-4-yl]benzamide
CID 46038111
N-[1-[2-(4-acetylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]-2-thiophen-2-ylacetamide
CID 46038077
4-ethyl-N-[1-[2-(4-methylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]benzamide
CID 46156215
1-[1-(2-methylbenzoyl)piperidin-4-yl]-3-propylurea
CID 110820264
N-[1-[2-[4-(2-ethoxyphenyl)piperazine-1-carbonyl]phenyl]piperidin-4-yl]cyclopropanecarboxamide
CID 24719026

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea?
The IUPAC name of 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea (CID 46038614) is 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea.
What is the SMILES notation for 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea?
The canonical SMILES for 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea is CCNC(=O)NC1CCN(c2ccccc2C(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea?
The InChIKey is LDNJUMULBWHEDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O3/c1-2-20-19(25)21-15-7-9-22(10-8-15)17-6-4-3-5-16(17)18(24)23-11-13-26-14-12-23/h3-6,15H,2,7-14H2,1H3,(H2,20,21,25).
What are the key properties of 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea?
1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea has a molecular weight of 360.46 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[1-[2-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]urea is sourced from PubChem (CID 46038614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).