1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea

C19H28N4O2 — CID 75477576

IUPAC1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea
SMILESCC(NC(=O)Nc1ccccc1CN1CCNC1=O)C1CCCCC1
InChIInChI=1S/C19H28N4O2/c1-14(15-7-3-2-4-8-15)21-18(24)22-17-10-6-5-9-16(17)13-23-12-11-20-19(23)25/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3,(H,20,25)(H2,21,22,24)
InChIKeyKZQKJDIJQHLURN-UHFFFAOYSA-N
MW344.46 g/mol
LogP3.30
Rot. Bonds5

About 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea

1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea (PubChem CID 75477576) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea.

Molecular Properties

Compound Name1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea
PubChem CID75477576
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC Name1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea
SMILESCC(NC(=O)Nc1ccccc1CN1CCNC1=O)C1CCCCC1
InChIInChI=1S/C19H28N4O2/c1-14(15-7-3-2-4-8-15)21-18(24)22-17-10-6-5-9-16(17)13-23-12-11-20-19(23)25/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3,(H,20,25)(H2,21,22,24)
InChIKeyKZQKJDIJQHLURN-UHFFFAOYSA-N
XLogP3.30
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 53.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]-3-[(1R)-1-phenylethyl]urea
CID 75505388
N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]pyrrolidine-1-carboxamide
CID 166204417
1-(1-cyclopropylethyl)-3-(2-ethylphenyl)urea
CID 47133266
2-(3-methylphenyl)-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]acetamide
CID 75472823
N-[2-[[[(1R)-1-cyclopentylethyl]amino]methyl]phenyl]acetamide
CID 81394935
3-fluoro-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]benzamide
CID 75517433
(3R)-3-ethyl-3-methyl-N-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]piperidine-1-carboxamide
CID 97305994
1-(2-fluorophenyl)-3-(1-piperidin-4-ylethyl)urea
CID 43523415
1-[[2-(1-methylpyrazol-4-yl)phenyl]methyl]-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea
CID 166211641
N-(1-cyclohexylethyl)-2-(pyrrolidin-1-ylmethyl)aniline
CID 43788848
N-(1-cyclohexylethyl)-2-(2-hydroxyphenyl)acetamide
CID 79039260
1-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]-3-[[3-(trifluoromethyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]urea
CID 166251008

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea?
The IUPAC name of 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea (CID 75477576) is 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea.
What is the SMILES notation for 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea?
The canonical SMILES for 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea is CC(NC(=O)Nc1ccccc1CN1CCNC1=O)C1CCCCC1.
What is the InChIKey of 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea?
The InChIKey is KZQKJDIJQHLURN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-14(15-7-3-2-4-8-15)21-18(24)22-17-10-6-5-9-16(17)13-23-12-11-20-19(23)25/h5-6,9-10,14-15H,2-4,7-8,11-13H2,1H3,(H,20,25)(H2,21,22,24).
What are the key properties of 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea?
1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea has a molecular weight of 344.46 g/mol, XLogP of 3.30, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylethyl)-3-[2-[(2-oxoimidazolidin-1-yl)methyl]phenyl]urea is sourced from PubChem (CID 75477576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).