2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride

C13H26ClN3O2 — CID 119430086

IUPAC2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride
SMILESCNCCCNC(=O)C(NC(C)=O)C1CCCC1.Cl
InChIInChI=1S/C13H25N3O2.ClH/c1-10(17)16-12(11-6-3-4-7-11)13(18)15-9-5-8-14-2;/h11-12,14H,3-9H2,1-2H3,(H,15,18)(H,16,17);1H
InChIKeyGVFJUMZFWQSQHN-UHFFFAOYSA-N
MW291.82 g/mol
LogP0.83
Rot. Bonds7

About 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride

2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride (PubChem CID 119430086) has the molecular formula C13H26ClN3O2 and a molecular weight of 291.82 g/mol. Its IUPAC name is 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride
PubChem CID119430086
Molecular FormulaC13H26ClN3O2
Molecular Weight291.82 g/mol
Exact Mass291.17
IUPAC Name2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride
SMILESCNCCCNC(=O)C(NC(C)=O)C1CCCC1.Cl
InChIInChI=1S/C13H25N3O2.ClH/c1-10(17)16-12(11-6-3-4-7-11)13(18)15-9-5-8-14-2;/h11-12,14H,3-9H2,1-2H3,(H,15,18)(H,16,17);1H
InChIKeyGVFJUMZFWQSQHN-UHFFFAOYSA-N
XLogP0.83
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.82
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-acetamido-N-[2-(cycloheptylamino)ethyl]-2-cyclopentylacetamide;hydrochloride
CID 119619470
2-acetamido-2-cyclopentyl-N-(3-piperazin-1-ylpropyl)acetamide;hydrochloride
CID 119391186
2-cyclohexyl-2-[3-(methylamino)propylcarbamoylamino]acetic acid
CID 61404684
2-acetamido-2-cyclopentyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 134026215
(2S)-2-acetamido-N-cyclooctyl-2-cyclopentylacetamide
CID 94491136
2-acetamido-2-cyclopentyl-N-(2-phenylethyl)acetamide
CID 51271986
2-acetamido-N-[2-(4-aminophenyl)ethyl]-2-cyclopentylacetamide
CID 119547727
2-acetamido-2-cyclopentyl-N-(2-piperidin-3-ylethyl)acetamide
CID 119555580
2-acetamido-2-cyclopentyl-N-piperidin-4-ylacetamide;hydrochloride
CID 119386391
methyl (2S)-2-[(2-acetamido-2-cyclopentylacetyl)amino]propanoate
CID 87040294
(2S)-2-acetamido-2-cyclopentylacetamide
CID 177134286
(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide
CID 27147840

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride?
The IUPAC name of 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride (CID 119430086) is 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride.
What is the SMILES notation for 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride?
The canonical SMILES for 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride is CNCCCNC(=O)C(NC(C)=O)C1CCCC1.Cl.
What is the InChIKey of 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride?
The InChIKey is GVFJUMZFWQSQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2.ClH/c1-10(17)16-12(11-6-3-4-7-11)13(18)15-9-5-8-14-2;/h11-12,14H,3-9H2,1-2H3,(H,15,18)(H,16,17);1H.
What are the key properties of 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride?
2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride has a molecular weight of 291.82 g/mol, XLogP of 0.83, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-2-cyclopentyl-N-[3-(methylamino)propyl]acetamide;hydrochloride is sourced from PubChem (CID 119430086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).