1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride

C8H18ClN3O — CID 154795316

IUPAC1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride
SMILESCNCCCN1CCN(C)C1=O.Cl
InChIInChI=1S/C8H17N3O.ClH/c1-9-4-3-5-11-7-6-10(2)8(11)12;/h9H,3-7H2,1-2H3;1H
InChIKeyNTFCLZPZIHNZTI-UHFFFAOYSA-N
MW207.70 g/mol
LogP0.39
Rot. Bonds4

About 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride

1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride (PubChem CID 154795316) has the molecular formula C8H18ClN3O and a molecular weight of 207.70 g/mol. Its IUPAC name is 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride.

Molecular Properties

Compound Name1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride
PubChem CID154795316
Molecular FormulaC8H18ClN3O
Molecular Weight207.70 g/mol
Exact Mass207.11
IUPAC Name1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride
SMILESCNCCCN1CCN(C)C1=O.Cl
InChIInChI=1S/C8H17N3O.ClH/c1-9-4-3-5-11-7-6-10(2)8(11)12;/h9H,3-7H2,1-2H3;1H
InChIKeyNTFCLZPZIHNZTI-UHFFFAOYSA-N
XLogP0.39
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.70
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[4-(Dimethylamino)-2-butynyl]-2-imidazolidinone
CID 15065515
3-(dimethylamino)-N-ethylpyrrolidine-1-carboxamide
CID 68378697
Urea, (1-ethyl-3-pyrrolidinyl)-
CID 209543
3-Methyl-1-(pyrrolidin-3-yl)urea
CID 22504281
1,3,3-Trimethyl-1-(pyrrolidin-3-yl)urea
CID 79154183
1-Ethylimidazolidin-2-one
CID 11378469
1-[1,3-Dimethyl-2-oxo-5-[[oxo(propylamino)methyl]amino]-4-imidazolidinyl]-3-propylurea
CID 656368
N,N-dimethyl-1,4-diazepane-1-carboxamide
CID 23090334
4,4-Dimethyl-1-tert-butylimidazolidin-2-one
CID 6422222
Piperazin-1-yl-pyrrolidin-1-yl-methanone
CID 2760443
1-(Pyrrolidin-1-ylcarbonyl)piperazine hydrochloride
CID 17406260
1-[3-(Dimethylamino)propyl]imidazolidin-2-one
CID 17776604

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride?
The IUPAC name of 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride (CID 154795316) is 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride.
What is the SMILES notation for 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride?
The canonical SMILES for 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride is CNCCCN1CCN(C)C1=O.Cl.
What is the InChIKey of 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride?
The InChIKey is NTFCLZPZIHNZTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O.ClH/c1-9-4-3-5-11-7-6-10(2)8(11)12;/h9H,3-7H2,1-2H3;1H.
What are the key properties of 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride?
1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride has a molecular weight of 207.70 g/mol, XLogP of 0.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[3-(methylamino)propyl]imidazolidin-2-one;hydrochloride is sourced from PubChem (CID 154795316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).