2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one

C15H19N3O2 — CID 82998420

IUPAC2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one
SMILESCCCOc1cccc(C2N=C(NC3CC3)NC2=O)c1
InChIInChI=1S/C15H19N3O2/c1-2-8-20-12-5-3-4-10(9-12)13-14(19)18-15(17-13)16-11-6-7-11/h3-5,9,11,13H,2,6-8H2,1H3,(H2,16,17,18,19)
InChIKeyDDDLCXZOSZOCRW-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.75
Rot. Bonds5

About 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one

2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one (PubChem CID 82998420) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one.

Molecular Properties

Compound Name2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one
PubChem CID82998420
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one
SMILESCCCOc1cccc(C2N=C(NC3CC3)NC2=O)c1
InChIInChI=1S/C15H19N3O2/c1-2-8-20-12-5-3-4-10(9-12)13-14(19)18-15(17-13)16-11-6-7-11/h3-5,9,11,13H,2,6-8H2,1H3,(H2,16,17,18,19)
InChIKeyDDDLCXZOSZOCRW-UHFFFAOYSA-N
XLogP1.75
TPSA62.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-4-(4-propan-2-ylphenyl)-1,4-dihydroimidazol-5-one
CID 82998176
5-(3-propoxyphenyl)-1,3-oxazolidine-2,4-dione
CID 114239608
1,1-dioxo-N-(3-propoxyphenyl)thian-4-amine
CID 43693787
3-propoxy-N-[4-(trifluoromethyl)cyclohexyl]aniline
CID 64753647
N-(3-propoxyphenyl)azepan-4-amine
CID 103981177
methyl (4R)-6-methyl-4-(3-propoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 7317875
N-[[2-(3-propoxyphenyl)oxan-3-yl]methyl]cyclopropanamine
CID 79370941
N-[2-(3-propoxyphenyl)ethyl]cyclopropanamine
CID 64866845
N-[(3-propoxyphenyl)methyl]cycloheptanamine
CID 29222103
N-(3-phenylcyclobutyl)-3-propoxyaniline
CID 43693771
N-(3-ethylcyclopentyl)-3-propoxyaniline
CID 64501066
1-N-(3-propoxyphenyl)cyclohexane-1,3-diamine
CID 79458462

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one?
The IUPAC name of 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one (CID 82998420) is 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one.
What is the SMILES notation for 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one?
The canonical SMILES for 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one is CCCOc1cccc(C2N=C(NC3CC3)NC2=O)c1.
What is the InChIKey of 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one?
The InChIKey is DDDLCXZOSZOCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-8-20-12-5-3-4-10(9-12)13-14(19)18-15(17-13)16-11-6-7-11/h3-5,9,11,13H,2,6-8H2,1H3,(H2,16,17,18,19).
What are the key properties of 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one?
2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one has a molecular weight of 273.34 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-4-(3-propoxyphenyl)-1,4-dihydroimidazol-5-one is sourced from PubChem (CID 82998420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).