1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea

C19H23N7O2 — CID 55809666

IUPAC1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea
SMILESO=C(Nc1cccc(N2CCNC2=O)c1)NC1CCCN(c2ncccn2)C1
InChIInChI=1S/C19H23N7O2/c27-18(23-14-4-1-6-16(12-14)26-11-9-22-19(26)28)24-15-5-2-10-25(13-15)17-20-7-3-8-21-17/h1,3-4,6-8,12,15H,2,5,9-11,13H2,(H,22,28)(H2,23,24,27)
InChIKeyAFCZGRFELUGXQE-UHFFFAOYSA-N
MW381.44 g/mol
LogP1.80
Rot. Bonds4

About 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea

1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea (PubChem CID 55809666) has the molecular formula C19H23N7O2 and a molecular weight of 381.44 g/mol. Its IUPAC name is 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea.

Molecular Properties

Compound Name1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea
PubChem CID55809666
Molecular FormulaC19H23N7O2
Molecular Weight381.44 g/mol
Exact Mass381.19
IUPAC Name1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea
SMILESO=C(Nc1cccc(N2CCNC2=O)c1)NC1CCCN(c2ncccn2)C1
InChIInChI=1S/C19H23N7O2/c27-18(23-14-4-1-6-16(12-14)26-11-9-22-19(26)28)24-15-5-2-10-25(13-15)17-20-7-3-8-21-17/h1,3-4,6-8,12,15H,2,5,9-11,13H2,(H,22,28)(H2,23,24,27)
InChIKeyAFCZGRFELUGXQE-UHFFFAOYSA-N
XLogP1.80
TPSA102.49 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47210940
1-[4-(5-methyltetrazol-1-yl)phenyl]-3-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]urea
CID 125161705
4-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120672792
(2R)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]pyrrolidine-2-carboxamide
CID 103795360
2-cyclopentyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]pyrrolidine-1-carboxamide
CID 71938993
1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-[3-[(2-oxopyrimidin-1-yl)methyl]phenyl]urea
CID 167757482
2-methyl-N-[2-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoylamino]ethyl]propanamide
CID 47039442
N-(1-pyrimidin-2-ylpiperidin-3-yl)piperidine-4-carboxamide
CID 43712323
1-(1-pyrimidin-2-ylpiperidin-3-yl)-3-(5,6,7,8-tetrahydronaphthalen-1-yl)urea
CID 55809342
3-N-[3-(2-oxoimidazolidin-1-yl)phenyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 55717175
N-[4-fluoro-3-[[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]carbamoylamino]phenyl]propanamide
CID 97438128
N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]acetamide
CID 79026340

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea?
The IUPAC name of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea (CID 55809666) is 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea.
What is the SMILES notation for 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea?
The canonical SMILES for 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea is O=C(Nc1cccc(N2CCNC2=O)c1)NC1CCCN(c2ncccn2)C1.
What is the InChIKey of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea?
The InChIKey is AFCZGRFELUGXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7O2/c27-18(23-14-4-1-6-16(12-14)26-11-9-22-19(26)28)24-15-5-2-10-25(13-15)17-20-7-3-8-21-17/h1,3-4,6-8,12,15H,2,5,9-11,13H2,(H,22,28)(H2,23,24,27).
What are the key properties of 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea?
1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea has a molecular weight of 381.44 g/mol, XLogP of 1.80, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-oxoimidazolidin-1-yl)phenyl]-3-(1-pyrimidin-2-ylpiperidin-3-yl)urea is sourced from PubChem (CID 55809666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).