4-imino-5-methyl-1,3-dipropylimidazolidin-2-one

C10H19N3O — CID 156894014

IUPAC4-imino-5-methyl-1,3-dipropylimidazolidin-2-one
SMILES[H]/N=C1\C(C)N(CCC)C(=O)N1CCC
InChIInChI=1S/C10H19N3O/c1-4-6-12-8(3)9(11)13(7-5-2)10(12)14/h8,11H,4-7H2,1-3H3/b11-9+
InChIKeyGJHSCXAXHQLENY-PKNBQFBNSA-N
MW197.28 g/mol
LogP1.91
Rot. Bonds4

About 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one

4-imino-5-methyl-1,3-dipropylimidazolidin-2-one (PubChem CID 156894014) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one.

Molecular Properties

Compound Name4-imino-5-methyl-1,3-dipropylimidazolidin-2-one
PubChem CID156894014
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name4-imino-5-methyl-1,3-dipropylimidazolidin-2-one
SMILES[H]/N=C1\C(C)N(CCC)C(=O)N1CCC
InChIInChI=1S/C10H19N3O/c1-4-6-12-8(3)9(11)13(7-5-2)10(12)14/h8,11H,4-7H2,1-3H3/b11-9+
InChIKeyGJHSCXAXHQLENY-PKNBQFBNSA-N
XLogP1.91
TPSA47.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1,5-diethyl-4-imino-3-methylimidazolidin-2-one
CID 167238533
5-bromo-6-imino-3-propyl-1,3-diazinane-2,4-dione
CID 140537494
6-amino-1-ethyl-3-propyl-1,3-diazinane-2,4-dione
CID 76845555
4-imino-5-(2-methylpropyl)-1-propylimidazolidin-2-one
CID 138388584
5-cyclobutyl-4-imino-1-propylimidazolidin-2-one
CID 138391173
4-imino-5-(5-methyloxolan-2-yl)-1-propylimidazolidin-2-one
CID 138391425
1-(2-hydroxyethyl)-5-methyl-3-(5-methyloctadecyl)imidazolidine-2,4-dione
CID 70602283
5-hydroxy-1-prop-2-enyl-3-propylimidazolidine-2,4-dione
CID 101336077
1-methyl-3-propyl-5-sulfanylimidazolidine-2,4-dione
CID 87233887
4-imino-5-(3-methylcyclohexyl)-1-propylimidazolidin-2-one
CID 138388397
3-methyl-1-propylpyrrolidine-2,5-dione;nonane
CID 163913553
4-imino-8-methyl-1-propyl-1,3-diazaspiro[4.4]nonan-2-one
CID 138388762

Frequently Asked Questions

What is the IUPAC name of 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one?
The IUPAC name of 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one (CID 156894014) is 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one.
What is the SMILES notation for 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one?
The canonical SMILES for 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one is [H]/N=C1\C(C)N(CCC)C(=O)N1CCC.
What is the InChIKey of 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one?
The InChIKey is GJHSCXAXHQLENY-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H19N3O/c1-4-6-12-8(3)9(11)13(7-5-2)10(12)14/h8,11H,4-7H2,1-3H3/b11-9+.
What are the key properties of 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one?
4-imino-5-methyl-1,3-dipropylimidazolidin-2-one has a molecular weight of 197.28 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imino-5-methyl-1,3-dipropylimidazolidin-2-one is sourced from PubChem (CID 156894014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).