1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one

C16H21N3O — CID 43696697

IUPAC1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one
SMILESO=C1NCCN1c1cccc(NC(C2CC2)C2CC2)c1
InChIInChI=1S/C16H21N3O/c20-16-17-8-9-19(16)14-3-1-2-13(10-14)18-15(11-4-5-11)12-6-7-12/h1-3,10-12,15,18H,4-9H2,(H,17,20)
InChIKeyKNBOWUDRBRLEFT-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.82
Rot. Bonds5

About 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one

1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one (PubChem CID 43696697) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one
PubChem CID43696697
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one
SMILESO=C1NCCN1c1cccc(NC(C2CC2)C2CC2)c1
InChIInChI=1S/C16H21N3O/c20-16-17-8-9-19(16)14-3-1-2-13(10-14)18-15(11-4-5-11)12-6-7-12/h1-3,10-12,15,18H,4-9H2,(H,17,20)
InChIKeyKNBOWUDRBRLEFT-UHFFFAOYSA-N
XLogP2.82
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(dicyclopropylmethylamino)phenyl]pyrrolidin-2-one
CID 43362855
1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one
CID 43783652
N-(dicyclopropylmethyl)-3-pyrazol-1-ylaniline
CID 43740005
N-[3-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47210940
N-(dicyclopropylmethyl)-3-pyrrol-1-ylaniline
CID 43733049
4-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120672792
N-(dicyclopropylmethyl)-3-(1,2,4-triazol-4-yl)aniline
CID 43692010
2-bromo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 107903731
1-[3-[(3-methylcyclohexyl)amino]phenyl]imidazolidin-2-one
CID 43696521
(2R)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]pyrrolidine-2-carboxamide
CID 103795360
N-[3-(2-oxoimidazolidin-1-yl)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119727665
4-benzamido-N-[3-(2-oxoimidazolidin-1-yl)phenyl]benzamide
CID 55726264

Frequently Asked Questions

What is the IUPAC name of 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one?
The IUPAC name of 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one (CID 43696697) is 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one is O=C1NCCN1c1cccc(NC(C2CC2)C2CC2)c1.
What is the InChIKey of 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one?
The InChIKey is KNBOWUDRBRLEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c20-16-17-8-9-19(16)14-3-1-2-13(10-14)18-15(11-4-5-11)12-6-7-12/h1-3,10-12,15,18H,4-9H2,(H,17,20).
What are the key properties of 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one?
1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one has a molecular weight of 271.36 g/mol, XLogP of 2.82, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one is sourced from PubChem (CID 43696697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).