2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide

C16H23FN2O — CID 60799977

IUPAC2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide
SMILESCCCN(C(=O)Cc1ccccc1F)C1CCCNC1
InChIInChI=1S/C16H23FN2O/c1-2-10-19(14-7-5-9-18-12-14)16(20)11-13-6-3-4-8-15(13)17/h3-4,6,8,14,18H,2,5,7,9-12H2,1H3
InChIKeyVAUWWKFWEMTLQB-UHFFFAOYSA-N
MW278.37 g/mol
LogP2.36
Rot. Bonds5

About 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide

2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide (PubChem CID 60799977) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide
PubChem CID60799977
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC Name2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide
SMILESCCCN(C(=O)Cc1ccccc1F)C1CCCNC1
InChIInChI=1S/C16H23FN2O/c1-2-10-19(14-7-5-9-18-12-14)16(20)11-13-6-3-4-8-15(13)17/h3-4,6,8,14,18H,2,5,7,9-12H2,1H3
InChIKeyVAUWWKFWEMTLQB-UHFFFAOYSA-N
XLogP2.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide
CID 60805878
2-(4-methylphenyl)-N-piperidin-3-yl-N-propylacetamide
CID 60799979
N-(2-chloroethyl)-N-cyclobutyl-2-(2-fluorophenyl)acetamide
CID 102872699
3-(2-fluorophenyl)-2-methyl-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 119532764
2-chloro-6-fluoro-N-piperidin-3-yl-N-propylbenzamide
CID 63636405
N-(2-amino-2-oxoethyl)-2-(2-fluorophenyl)-N-pyrrolidin-3-ylacetamide
CID 60806860
2-phenyl-N-propyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119532603
N-(2-bromoethyl)-N-cyclohexyl-2-(2-fluorophenyl)acetamide
CID 80659219
3-phenyl-N-piperidin-3-yl-N-propylprop-2-enamide
CID 77002821
4-fluoro-3-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63209531
3-(2,5-difluorophenyl)-N-propyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119532213
5-fluoro-2-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63050163

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide (CID 60799977) is 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide is CCCN(C(=O)Cc1ccccc1F)C1CCCNC1.
What is the InChIKey of 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide?
The InChIKey is VAUWWKFWEMTLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-2-10-19(14-7-5-9-18-12-14)16(20)11-13-6-3-4-8-15(13)17/h3-4,6,8,14,18H,2,5,7,9-12H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide?
2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide has a molecular weight of 278.37 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-piperidin-3-yl-N-propylacetamide is sourced from PubChem (CID 60799977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).