1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one

C8H17N3O — CID 130622371

IUPAC1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one
SMILESCN1CN(CC(C)(C)N)CC1=O
InChIInChI=1S/C8H17N3O/c1-8(2,9)5-11-4-7(12)10(3)6-11/h4-6,9H2,1-3H3
InChIKeyLSOHJDRNMLLASQ-UHFFFAOYSA-N
MW171.24 g/mol
LogP-0.54
Rot. Bonds2

About 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one

1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one (PubChem CID 130622371) has the molecular formula C8H17N3O and a molecular weight of 171.24 g/mol. Its IUPAC name is 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one.

Molecular Properties

Compound Name1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one
PubChem CID130622371
Molecular FormulaC8H17N3O
Molecular Weight171.24 g/mol
Exact Mass171.14
IUPAC Name1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one
SMILESCN1CN(CC(C)(C)N)CC1=O
InChIInChI=1S/C8H17N3O/c1-8(2,9)5-11-4-7(12)10(3)6-11/h4-6,9H2,1-3H3
InChIKeyLSOHJDRNMLLASQ-UHFFFAOYSA-N
XLogP-0.54
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 126989037
3-methyl-1-(3,3,3-trichloropropyl)imidazolidin-4-one
CID 126990347
2-(3-methyl-4-oxoimidazolidin-1-yl)acetamide
CID 127013719
[2-methyl-1-(4-methyl-3-oxopiperazin-1-yl)propan-2-yl] carbamate
CID 151685757
3-methyl-1-(thiolan-3-ylmethyl)imidazolidin-4-one
CID 127002211
3-(3-amino-3-methylbutyl)-1-methylimidazolidine-2,4-dione
CID 83819144
4-(2-amino-2-methylpropyl)-1,2,4-triazolidine-3,5-dione
CID 107410051
4-(3,3-dimethyl-2-oxobutyl)-1-methyl-1,4-diazepan-2-one
CID 102889641
1,4,7-trimethyl-1,4,7-triazonane-2,5,8-trione
CID 71358039
3-methyl-1-(1H-pyrrol-2-ylmethyl)imidazolidin-4-one
CID 130770177
1-(2,2-dimethylpropanoyl)-3-methylimidazolidin-4-one
CID 130670161
1-[4-(2-aminoethyl)piperazin-1-yl]-2-methylpropan-2-amine
CID 45117280

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one?
The IUPAC name of 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one (CID 130622371) is 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one.
What is the SMILES notation for 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one?
The canonical SMILES for 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one is CN1CN(CC(C)(C)N)CC1=O.
What is the InChIKey of 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one?
The InChIKey is LSOHJDRNMLLASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O/c1-8(2,9)5-11-4-7(12)10(3)6-11/h4-6,9H2,1-3H3.
What are the key properties of 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one?
1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one has a molecular weight of 171.24 g/mol, XLogP of -0.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-methylpropyl)-3-methylimidazolidin-4-one is sourced from PubChem (CID 130622371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).