1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea

C18H27N5O3 — CID 118772403

IUPAC1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
SMILESCN1CCC(Oc2ccccc2NC(=O)NCCN2CCNC2=O)CC1
InChIInChI=1S/C18H27N5O3/c1-22-10-6-14(7-11-22)26-16-5-3-2-4-15(16)21-17(24)19-8-12-23-13-9-20-18(23)25/h2-5,14H,6-13H2,1H3,(H,20,25)(H2,19,21,24)
InChIKeyUEVWOROEDQYWMC-UHFFFAOYSA-N
MW361.45 g/mol
LogP1.31
Rot. Bonds6

About 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea

1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea (PubChem CID 118772403) has the molecular formula C18H27N5O3 and a molecular weight of 361.45 g/mol. Its IUPAC name is 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea.

Molecular Properties

Compound Name1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
PubChem CID118772403
Molecular FormulaC18H27N5O3
Molecular Weight361.45 g/mol
Exact Mass361.21
IUPAC Name1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
SMILESCN1CCC(Oc2ccccc2NC(=O)NCCN2CCNC2=O)CC1
InChIInChI=1S/C18H27N5O3/c1-22-10-6-14(7-11-22)26-16-5-3-2-4-15(16)21-17(24)19-8-12-23-13-9-20-18(23)25/h2-5,14H,6-13H2,1H3,(H,20,25)(H2,19,21,24)
InChIKeyUEVWOROEDQYWMC-UHFFFAOYSA-N
XLogP1.31
TPSA85.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 51.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea with MolForge

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Related Compounds

1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-(3-pyridin-2-ylpropyl)urea
CID 118775035
1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 2810883
1-(2,1,3-benzothiadiazol-4-yl)-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 72882799
methyl 2-[2-(1-methylpiperidin-4-yl)oxyphenyl]acetate
CID 117054228
1-[2-(2-chlorophenoxy)phenyl]-3-[2-(1-methylpiperidin-4-yl)ethyl]urea
CID 56519173
1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-(4-phenylmethoxyphenyl)urea
CID 2810884
1-[3-(methanesulfonamido)-4-methoxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 118763815
1-[(2R)-1-(3,5-dimethylpyrazol-1-yl)propan-2-yl]-3-[2-(1-methylpiperidin-4-yl)oxyphenyl]urea
CID 97443408
1-(2-chloro-4-fluoro-5-methylphenyl)-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 118783630
1-(2-benzylpyrazol-3-yl)-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 72888153
2-(1-methylpiperidin-4-yl)oxybenzoic acid
CID 39203185
1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-(1-phenyl-3-propan-2-ylpyrazol-5-yl)urea
CID 72870620

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
The IUPAC name of 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea (CID 118772403) is 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea.
What is the SMILES notation for 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
The canonical SMILES for 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea is CN1CCC(Oc2ccccc2NC(=O)NCCN2CCNC2=O)CC1.
What is the InChIKey of 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
The InChIKey is UEVWOROEDQYWMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O3/c1-22-10-6-14(7-11-22)26-16-5-3-2-4-15(16)21-17(24)19-8-12-23-13-9-20-18(23)25/h2-5,14H,6-13H2,1H3,(H,20,25)(H2,19,21,24).
What are the key properties of 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea has a molecular weight of 361.45 g/mol, XLogP of 1.31, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea is sourced from PubChem (CID 118772403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).