1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one

C16H25N3O2 — CID 62491666

IUPAC1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one
SMILESCCCNC(CN1CCN(C)C1=O)c1ccc(OC)cc1
InChIInChI=1S/C16H25N3O2/c1-4-9-17-15(12-19-11-10-18(2)16(19)20)13-5-7-14(21-3)8-6-13/h5-8,15,17H,4,9-12H2,1-3H3
InChIKeyCHZVNMDEHGBDDB-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.10
Rot. Bonds7

About 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one

1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one (PubChem CID 62491666) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one
PubChem CID62491666
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC Name1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one
SMILESCCCNC(CN1CCN(C)C1=O)c1ccc(OC)cc1
InChIInChI=1S/C16H25N3O2/c1-4-9-17-15(12-19-11-10-18(2)16(19)20)13-5-7-14(21-3)8-6-13/h5-8,15,17H,4,9-12H2,1-3H3
InChIKeyCHZVNMDEHGBDDB-UHFFFAOYSA-N
XLogP2.10
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazol-2-one
CID 80579653
1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]pyridin-4-one
CID 62879646
1-[2-hydroxy-2-(4-propoxyphenyl)ethyl]-3-methylimidazolidin-2-one
CID 62492041
N-[2-(cyclopentylmethoxy)-1-(4-methoxyphenyl)ethyl]propan-1-amine
CID 66324313
N-[1-(4-methoxyphenyl)-2-propylsulfinylethyl]propan-1-amine
CID 64652367
1-methyl-3-[2-(methylamino)-2-[4-(2-methylpropyl)phenyl]ethyl]imidazolidin-2-one
CID 62491482
1-(4-methoxyphenyl)-5-methyl-N-propylhexan-1-amine
CID 83161012
N-[1-(4-methoxyphenyl)-2-phenylethyl]propan-1-amine
CID 43495037
1-(4-methoxyphenyl)-4,4-dimethyl-N-propylpentan-1-amine
CID 63414142
N-[1-(4-methoxyphenyl)-2-(2-methylpropylsulfinyl)ethyl]propan-1-amine
CID 64651022
1-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]-3-methylimidazolidin-2-one
CID 62492213
1-[2-(ethylamino)-2-(2-methylphenyl)ethyl]-3-methylimidazolidin-2-one
CID 62490466

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one?
The IUPAC name of 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one (CID 62491666) is 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one?
The canonical SMILES for 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one is CCCNC(CN1CCN(C)C1=O)c1ccc(OC)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one?
The InChIKey is CHZVNMDEHGBDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-4-9-17-15(12-19-11-10-18(2)16(19)20)13-5-7-14(21-3)8-6-13/h5-8,15,17H,4,9-12H2,1-3H3.
What are the key properties of 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one?
1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one has a molecular weight of 291.40 g/mol, XLogP of 2.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazolidin-2-one is sourced from PubChem (CID 62491666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).