1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one

C15H23N3O — CID 43783652

IUPAC1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one
SMILESCCC(Nc1cccc(N2CCNC2=O)c1)C(C)C
InChIInChI=1S/C15H23N3O/c1-4-14(11(2)3)17-12-6-5-7-13(10-12)18-9-8-16-15(18)19/h5-7,10-11,14,17H,4,8-9H2,1-3H3,(H,16,19)
InChIKeyKYDNHFXSEFACOS-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.06
Rot. Bonds5

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

1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one (PubChem CID 43783652) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one
PubChem CID43783652
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one
SMILESCCC(Nc1cccc(N2CCNC2=O)c1)C(C)C
InChIInChI=1S/C15H23N3O/c1-4-14(11(2)3)17-12-6-5-7-13(10-12)18-9-8-16-15(18)19/h5-7,10-11,14,17H,4,8-9H2,1-3H3,(H,16,19)
InChIKeyKYDNHFXSEFACOS-UHFFFAOYSA-N
XLogP3.06
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(dicyclopropylmethylamino)phenyl]imidazolidin-2-one
CID 43696697
N-[3-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47210940
2-bromo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 107903731
(2S)-2-(2-methylpropoxy)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 94123689
2-methyl-N-[2-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoylamino]ethyl]propanamide
CID 47039442
1-[3-[[2-ethyl-2-(hydroxymethyl)butyl]amino]phenyl]imidazolidin-2-one
CID 81401096
1-[3-[(3-methylphenyl)methylamino]phenyl]imidazolidin-2-one
CID 43696493
(2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide
CID 103831459
3-fluoro-N-[(3S)-2-methylpentan-3-yl]aniline
CID 93282117
3-chloro-2,2-dimethyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 63679045
1-[3-[(5-methylthiophen-2-yl)methylamino]phenyl]imidazolidin-2-one
CID 43696383
1-(2-methylprop-2-enyl)-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 100624959

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one?
The IUPAC name of 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one (CID 43783652) is 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one is CCC(Nc1cccc(N2CCNC2=O)c1)C(C)C.
What is the InChIKey of 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one?
The InChIKey is KYDNHFXSEFACOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-4-14(11(2)3)17-12-6-5-7-13(10-12)18-9-8-16-15(18)19/h5-7,10-11,14,17H,4,8-9H2,1-3H3,(H,16,19).
What are the key properties of 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one?
1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one has a molecular weight of 261.37 g/mol, XLogP of 3.06, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methylpentan-3-ylamino)phenyl]imidazolidin-2-one is sourced from PubChem (CID 43783652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).