2-chloro-2-(2-propylpiperidin-1-yl)acetamide

C10H19ClN2O — CID 70633548

IUPAC2-chloro-2-(2-propylpiperidin-1-yl)acetamide
SMILESCCCC1CCCCN1C(Cl)C(N)=O
InChIInChI=1S/C10H19ClN2O/c1-2-5-8-6-3-4-7-13(8)9(11)10(12)14/h8-9H,2-7H2,1H3,(H2,12,14)
InChIKeyHLXAMVNWVPDLIK-UHFFFAOYSA-N
MW218.73 g/mol
LogP1.69
Rot. Bonds4

About 2-chloro-2-(2-propylpiperidin-1-yl)acetamide

2-chloro-2-(2-propylpiperidin-1-yl)acetamide (PubChem CID 70633548) has the molecular formula C10H19ClN2O and a molecular weight of 218.73 g/mol. Its IUPAC name is 2-chloro-2-(2-propylpiperidin-1-yl)acetamide.

Molecular Properties

Compound Name2-chloro-2-(2-propylpiperidin-1-yl)acetamide
PubChem CID70633548
Molecular FormulaC10H19ClN2O
Molecular Weight218.73 g/mol
Exact Mass218.12
IUPAC Name2-chloro-2-(2-propylpiperidin-1-yl)acetamide
SMILESCCCC1CCCCN1C(Cl)C(N)=O
InChIInChI=1S/C10H19ClN2O/c1-2-5-8-6-3-4-7-13(8)9(11)10(12)14/h8-9H,2-7H2,1H3,(H2,12,14)
InChIKeyHLXAMVNWVPDLIK-UHFFFAOYSA-N
XLogP1.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.73
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(2-propylpyrrolidin-1-yl)butanamide
CID 154632136
2-(2-propylpiperidin-1-yl)pentan-3-one
CID 83056378
3-(2-propylpiperidin-1-yl)butanoic acid
CID 83055410
4-amino-2-(2-propylpiperidin-1-yl)butanoic acid
CID 83057524
4-(2-propylpiperidin-1-yl)pentanehydrazide
CID 83056932
3-[1-(1-amino-1-oxobutan-2-yl)piperidin-2-yl]propanoic acid
CID 62901019
2-amino-4-(2-propylpiperidin-1-yl)butanamide
CID 83062448
2-(2-propylpiperidin-1-yl)pentan-3-amine
CID 83053461
4-amino-N-propyl-3-(2-propylpiperidin-1-yl)butanamide
CID 83053457
2-(2-ethylazepan-1-yl)butanamide
CID 104691437
butyl 2-[2-(2-hydroxyethyl)piperidin-1-yl]propanoate
CID 111461966
1-phenyl-2-(2-propylpiperidin-1-yl)propan-1-one
CID 83055659

Frequently Asked Questions

What is the IUPAC name of 2-chloro-2-(2-propylpiperidin-1-yl)acetamide?
The IUPAC name of 2-chloro-2-(2-propylpiperidin-1-yl)acetamide (CID 70633548) is 2-chloro-2-(2-propylpiperidin-1-yl)acetamide.
What is the SMILES notation for 2-chloro-2-(2-propylpiperidin-1-yl)acetamide?
The canonical SMILES for 2-chloro-2-(2-propylpiperidin-1-yl)acetamide is CCCC1CCCCN1C(Cl)C(N)=O.
What is the InChIKey of 2-chloro-2-(2-propylpiperidin-1-yl)acetamide?
The InChIKey is HLXAMVNWVPDLIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClN2O/c1-2-5-8-6-3-4-7-13(8)9(11)10(12)14/h8-9H,2-7H2,1H3,(H2,12,14).
What are the key properties of 2-chloro-2-(2-propylpiperidin-1-yl)acetamide?
2-chloro-2-(2-propylpiperidin-1-yl)acetamide has a molecular weight of 218.73 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-2-(2-propylpiperidin-1-yl)acetamide is sourced from PubChem (CID 70633548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).