1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one

C14H28N4O — CID 116981390

IUPAC1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one
SMILESCN1CCCC(C2CN(C(C)(C)CN)C(=O)N2C)C1
InChIInChI=1S/C14H28N4O/c1-14(2,10-15)18-9-12(17(4)13(18)19)11-6-5-7-16(3)8-11/h11-12H,5-10,15H2,1-4H3
InChIKeyJRSQSVGZBRMEHT-UHFFFAOYSA-N
MW268.40 g/mol
LogP0.80
Rot. Bonds3

About 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one

1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one (PubChem CID 116981390) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one
PubChem CID116981390
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC Name1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one
SMILESCN1CCCC(C2CN(C(C)(C)CN)C(=O)N2C)C1
InChIInChI=1S/C14H28N4O/c1-14(2,10-15)18-9-12(17(4)13(18)19)11-6-5-7-16(3)8-11/h11-12H,5-10,15H2,1-4H3
InChIKeyJRSQSVGZBRMEHT-UHFFFAOYSA-N
XLogP0.80
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-hydroxyethyl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one
CID 116981965
3-methyl-4-(1-methylpiperidin-3-yl)-1-propan-2-ylimidazolidin-2-one
CID 116983171
3-(4-cyclopentyl-3-methyl-2-oxoimidazolidin-1-yl)-3-methylbutanoic acid
CID 116982156
1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-propylimidazolidin-2-one
CID 116981362
2-(4-cyclobutyl-3-methyl-2-oxoimidazolidin-1-yl)-2-methylpropanoic acid
CID 116982096
1-(3-aminopropyl)-3-methyl-4-(1-methylpyrrolidin-3-yl)imidazolidin-2-one
CID 116981471
1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(2-methylpropyl)imidazolidin-2-one
CID 116981363
1,3-bis(1-amino-2-methylpropan-2-yl)-1,3-diazinan-2-one
CID 67781043
methyl 2-(4-cyclobutyl-3-methyl-2-oxoimidazolidin-1-yl)-2-methylpropanoate
CID 116982621
2-methyl-2-[3-methyl-4-(1-methylpiperidin-4-yl)-2-oxoimidazolidin-1-yl]propanenitrile
CID 116982651
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-methylpropan-1-amine
CID 82747633
1-(1-amino-2-methylpropan-2-yl)-4-(2-bromophenyl)-3-methylimidazolidin-2-one
CID 116981388

Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one?
The IUPAC name of 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one (CID 116981390) is 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one?
The canonical SMILES for 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one is CN1CCCC(C2CN(C(C)(C)CN)C(=O)N2C)C1.
What is the InChIKey of 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one?
The InChIKey is JRSQSVGZBRMEHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-14(2,10-15)18-9-12(17(4)13(18)19)11-6-5-7-16(3)8-11/h11-12H,5-10,15H2,1-4H3.
What are the key properties of 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one?
1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one has a molecular weight of 268.40 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-2-methylpropan-2-yl)-3-methyl-4-(1-methylpiperidin-3-yl)imidazolidin-2-one is sourced from PubChem (CID 116981390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).