3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide

C18H26F2N2O2 — CID 119825341

IUPAC3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide
SMILESCCCN(C(=O)CCc1ccc(OC(F)F)cc1)C1CCNCC1
InChIInChI=1S/C18H26F2N2O2/c1-2-13-22(15-9-11-21-12-10-15)17(23)8-5-14-3-6-16(7-4-14)24-18(19)20/h3-4,6-7,15,18,21H,2,5,8-13H2,1H3
InChIKeyYDLZNZCNOJRJHC-UHFFFAOYSA-N
MW340.41 g/mol
LogP3.21
Rot. Bonds8

About 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide

3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide (PubChem CID 119825341) has the molecular formula C18H26F2N2O2 and a molecular weight of 340.41 g/mol. Its IUPAC name is 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide.

Molecular Properties

Compound Name3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide
PubChem CID119825341
Molecular FormulaC18H26F2N2O2
Molecular Weight340.41 g/mol
Exact Mass340.20
IUPAC Name3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide
SMILESCCCN(C(=O)CCc1ccc(OC(F)F)cc1)C1CCNCC1
InChIInChI=1S/C18H26F2N2O2/c1-2-13-22(15-9-11-21-12-10-15)17(23)8-5-14-3-6-16(7-4-14)24-18(19)20/h3-4,6-7,15,18,21H,2,5,8-13H2,1H3
InChIKeyYDLZNZCNOJRJHC-UHFFFAOYSA-N
XLogP3.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(difluoromethoxy)phenyl]-N-methyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119553266
3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119825837
5-(4-methylphenyl)-N-piperidin-4-yl-N-propylpentanamide
CID 119823684
5-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylthiophene-2-carboxamide;hydrochloride
CID 119825454
4-(3,4-difluorophenyl)-N-piperidin-4-yl-N-propylbutanamide
CID 119824702
2-(2-phenylethoxy)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119825872
2-(4-methoxyphenyl)-N-propyl-N-pyrrolidin-3-ylacetamide
CID 60807367
3-(3-nitrophenyl)-N-piperidin-4-yl-N-propylpropanamide
CID 119823365
N-piperidin-4-yl-N-propyl-3-[2-(trifluoromethoxy)phenyl]propanamide
CID 119825481
1-[4-(difluoromethoxy)phenyl]-5-methyl-N-propyl-N-pyrrolidin-3-yltriazole-4-carboxamide;hydrochloride
CID 119532288
4-(3,4-dichlorophenyl)-N-piperidin-4-yl-N-propylbutanamide;hydrochloride
CID 119824958
N-piperidin-4-yl-2-(4-propoxyphenoxy)-N-propylacetamide;hydrochloride
CID 119823177

Frequently Asked Questions

What is the IUPAC name of 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide?
The IUPAC name of 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide (CID 119825341) is 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide.
What is the SMILES notation for 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide?
The canonical SMILES for 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide is CCCN(C(=O)CCc1ccc(OC(F)F)cc1)C1CCNCC1.
What is the InChIKey of 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide?
The InChIKey is YDLZNZCNOJRJHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26F2N2O2/c1-2-13-22(15-9-11-21-12-10-15)17(23)8-5-14-3-6-16(7-4-14)24-18(19)20/h3-4,6-7,15,18,21H,2,5,8-13H2,1H3.
What are the key properties of 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide?
3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide has a molecular weight of 340.41 g/mol, XLogP of 3.21, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(difluoromethoxy)phenyl]-N-piperidin-4-yl-N-propylpropanamide is sourced from PubChem (CID 119825341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).