N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide

C24H24FN3O — CID 113015460

IUPACN-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide
SMILESO=C(Nc1ccc(N2CCC(Cc3ccccc3)CC2)nc1)c1cccc(F)c1
InChIInChI=1S/C24H24FN3O/c25-21-8-4-7-20(16-21)24(29)27-22-9-10-23(26-17-22)28-13-11-19(12-14-28)15-18-5-2-1-3-6-18/h1-10,16-17,19H,11-15H2,(H,27,29)
InChIKeyMRAPJWLIMHFZJC-UHFFFAOYSA-N
MW389.47 g/mol
LogP4.93
Rot. Bonds5

About N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide

N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide (PubChem CID 113015460) has the molecular formula C24H24FN3O and a molecular weight of 389.47 g/mol. Its IUPAC name is N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide.

Molecular Properties

Compound NameN-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide
PubChem CID113015460
Molecular FormulaC24H24FN3O
Molecular Weight389.47 g/mol
Exact Mass389.19
IUPAC NameN-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide
SMILESO=C(Nc1ccc(N2CCC(Cc3ccccc3)CC2)nc1)c1cccc(F)c1
InChIInChI=1S/C24H24FN3O/c25-21-8-4-7-20(16-21)24(29)27-22-9-10-23(26-17-22)28-13-11-19(12-14-28)15-18-5-2-1-3-6-18/h1-10,16-17,19H,11-15H2,(H,27,29)
InChIKeyMRAPJWLIMHFZJC-UHFFFAOYSA-N
XLogP4.93
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.47
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-2-fluorobenzamide
CID 113015459
N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]cyclopropanecarboxamide
CID 113015446
3-fluoro-N-[6-[4-(2-fluorophenyl)piperazin-1-yl]-3-pyridinyl]benzamide
CID 113014415
6-(4-benzylpiperidin-1-yl)-N-(4-cyanophenyl)pyridine-3-carboxamide
CID 109161603
2-(4-benzylpiperidin-1-yl)-5-[(3-fluorobenzoyl)amino]-N-propan-2-ylbenzamide
CID 5032503
3-(4-benzylpiperidin-1-yl)sulfonyl-N-(4-fluorophenyl)benzamide
CID 3436224
N-[4-(4-benzylpiperidine-1-carbonyl)-1-phenylpyrazol-5-yl]-3-fluorobenzamide
CID 2892347
3-[[1-[5-[(2-benzylbenzoyl)amino]-2-pyridinyl]piperidin-4-yl]methoxy]benzoic acid
CID 56839514
N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3-(methylsulfinylmethyl)benzamide
CID 18153700
N-[6-[4-(3-fluorobenzoyl)piperazin-1-yl]-3-pyridinyl]-4-(trifluoromethyl)benzamide
CID 46041909
2-(4-benzylpiperidin-1-yl)-N-(4-methylphenyl)pyrimidine-5-carboxamide
CID 109264116
N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-3-(methylsulfonylmethyl)benzamide
CID 26126263

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide?
The IUPAC name of N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide (CID 113015460) is N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide.
What is the SMILES notation for N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide?
The canonical SMILES for N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide is O=C(Nc1ccc(N2CCC(Cc3ccccc3)CC2)nc1)c1cccc(F)c1.
What is the InChIKey of N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide?
The InChIKey is MRAPJWLIMHFZJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN3O/c25-21-8-4-7-20(16-21)24(29)27-22-9-10-23(26-17-22)28-13-11-19(12-14-28)15-18-5-2-1-3-6-18/h1-10,16-17,19H,11-15H2,(H,27,29).
What are the key properties of N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide?
N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide has a molecular weight of 389.47 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]-3-fluorobenzamide is sourced from PubChem (CID 113015460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).