2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide

C17H25FN2O — CID 62510083

IUPAC2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide
SMILESCc1ccc(F)c(C(=O)N(C)C2CCN(C(C)C)CC2)c1
InChIInChI=1S/C17H25FN2O/c1-12(2)20-9-7-14(8-10-20)19(4)17(21)15-11-13(3)5-6-16(15)18/h5-6,11-12,14H,7-10H2,1-4H3
InChIKeyUNAYSPUULCJCSD-UHFFFAOYSA-N
MW292.40 g/mol
LogP3.08
Rot. Bonds3

About 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide

2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide (PubChem CID 62510083) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide
PubChem CID62510083
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC Name2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide
SMILESCc1ccc(F)c(C(=O)N(C)C2CCN(C(C)C)CC2)c1
InChIInChI=1S/C17H25FN2O/c1-12(2)20-9-7-14(8-10-20)19(4)17(21)15-11-13(3)5-6-16(15)18/h5-6,11-12,14H,7-10H2,1-4H3
InChIKeyUNAYSPUULCJCSD-UHFFFAOYSA-N
XLogP3.08
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
The IUPAC name of 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide (CID 62510083) is 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
The canonical SMILES for 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide is Cc1ccc(F)c(C(=O)N(C)C2CCN(C(C)C)CC2)c1.
What is the InChIKey of 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
The InChIKey is UNAYSPUULCJCSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c1-12(2)20-9-7-14(8-10-20)19(4)17(21)15-11-13(3)5-6-16(15)18/h5-6,11-12,14H,7-10H2,1-4H3.
What are the key properties of 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide has a molecular weight of 292.40 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,5-dimethyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide is sourced from PubChem (CID 62510083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).