1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea

C18H26N4O3 — CID 56794708

IUPAC1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea
SMILESCCCN1CCC(NC(=O)Nc2ccc(N3CCOC3=O)cc2)CC1
InChIInChI=1S/C18H26N4O3/c1-2-9-21-10-7-15(8-11-21)20-17(23)19-14-3-5-16(6-4-14)22-12-13-25-18(22)24/h3-6,15H,2,7-13H2,1H3,(H2,19,20,23)
InChIKeyWEMDNNGWNUVUIJ-UHFFFAOYSA-N
MW346.43 g/mol
LogP2.64
Rot. Bonds5

About 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea

1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea (PubChem CID 56794708) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea.

Molecular Properties

Compound Name1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea
PubChem CID56794708
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea
SMILESCCCN1CCC(NC(=O)Nc2ccc(N3CCOC3=O)cc2)CC1
InChIInChI=1S/C18H26N4O3/c1-2-9-21-10-7-15(8-11-21)20-17(23)19-14-3-5-16(6-4-14)22-12-13-25-18(22)24/h3-6,15H,2,7-13H2,1H3,(H2,19,20,23)
InChIKeyWEMDNNGWNUVUIJ-UHFFFAOYSA-N
XLogP2.64
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

oxo-[4-[(1-propylpiperidin-4-yl)carbamoylamino]phenyl]azanium
CID 140907563
1-hexyl-3-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]urea
CID 60545931
1-cyclopentyl-3-[4-(3-methyl-2-oxo-1,3-diazinan-1-yl)phenyl]urea
CID 110666930
1-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-3-(1-phenylpiperidin-4-yl)urea
CID 86830752
N-[4-[(1-propylpiperidin-4-yl)amino]phenyl]propanamide
CID 43720611
1-(2-ethoxyphenyl)-3-(1-propylpiperidin-4-yl)urea
CID 6468357
1-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-3-(1-propylpiperidin-4-yl)urea
CID 97248271
1-(3-benzyl-4-methoxyphenyl)-3-(1-propylpiperidin-4-yl)urea
CID 78832230
N-(4-methylphenyl)-2-[(1-propylpiperidin-4-yl)amino]acetamide
CID 60695712
3,4-dimethyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]benzamide
CID 110363407
1-(4-iodophenyl)-3-(1-methylpiperidin-4-yl)urea
CID 47133004
1-[(3S,4R)-4-ethoxyoxolan-3-yl]-3-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]urea
CID 118771882

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea?
The IUPAC name of 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea (CID 56794708) is 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea.
What is the SMILES notation for 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea?
The canonical SMILES for 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea is CCCN1CCC(NC(=O)Nc2ccc(N3CCOC3=O)cc2)CC1.
What is the InChIKey of 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea?
The InChIKey is WEMDNNGWNUVUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-2-9-21-10-7-15(8-11-21)20-17(23)19-14-3-5-16(6-4-14)22-12-13-25-18(22)24/h3-6,15H,2,7-13H2,1H3,(H2,19,20,23).
What are the key properties of 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea?
1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea has a molecular weight of 346.43 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(1-propylpiperidin-4-yl)urea is sourced from PubChem (CID 56794708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).