2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide

C16H23FN2O2 — CID 103603316

IUPAC2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide
SMILESCCCN1CCC(NC(=O)c2ccc(OC)cc2F)CC1
InChIInChI=1S/C16H23FN2O2/c1-3-8-19-9-6-12(7-10-19)18-16(20)14-5-4-13(21-2)11-15(14)17/h4-5,11-12H,3,6-10H2,1-2H3,(H,18,20)
InChIKeySPSFHGKBZFTYDW-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.44
Rot. Bonds5

About 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide

2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide (PubChem CID 103603316) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide
PubChem CID103603316
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC Name2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide
SMILESCCCN1CCC(NC(=O)c2ccc(OC)cc2F)CC1
InChIInChI=1S/C16H23FN2O2/c1-3-8-19-9-6-12(7-10-19)18-16(20)14-5-4-13(21-2)11-15(14)17/h4-5,11-12H,3,6-10H2,1-2H3,(H,18,20)
InChIKeySPSFHGKBZFTYDW-UHFFFAOYSA-N
XLogP2.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-5-methoxy-N-(1-propylpiperidin-4-yl)benzamide
CID 60712481
2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 103603318
N-(4-bromocyclohexyl)-2-fluoro-4-methoxybenzamide
CID 102885227
3,5-dimethoxy-N-(1-propylpiperidin-4-yl)benzamide
CID 17250187
2-fluoro-N-[3-(4-hydroxypiperidin-1-yl)propyl]-4-methoxybenzamide
CID 111429422
2-fluoro-4-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 113219291
N-(1-ethylpiperidin-4-yl)-2,4-difluorobenzamide
CID 36811979
2-hydroxy-4-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 60664803
2-fluoro-4-methoxy-N-(2-propylcyclopropyl)benzamide
CID 103713574
2-amino-4-bromo-N-(1-propylpiperidin-4-yl)benzamide
CID 79722366
4-(4-methoxyphenoxy)-N-(1-propylpiperidin-4-yl)butanamide
CID 86907108
N-(4-aminocyclohexyl)-2-fluoro-4-(2-fluoro-4-methoxyphenyl)benzamide
CID 119476668

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide?
The IUPAC name of 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide (CID 103603316) is 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide?
The canonical SMILES for 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide is CCCN1CCC(NC(=O)c2ccc(OC)cc2F)CC1.
What is the InChIKey of 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide?
The InChIKey is SPSFHGKBZFTYDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-3-8-19-9-6-12(7-10-19)18-16(20)14-5-4-13(21-2)11-15(14)17/h4-5,11-12H,3,6-10H2,1-2H3,(H,18,20).
What are the key properties of 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide?
2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide has a molecular weight of 294.37 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide is sourced from PubChem (CID 103603316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).