N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide

C25H25N3O2 — CID 109081326

IUPACN-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide
SMILESO=C(c1cc(C(=O)N(Cc2ccccc2)c2ccccc2)ccn1)N1CCCCC1
InChIInChI=1S/C25H25N3O2/c29-24(21-14-15-26-23(18-21)25(30)27-16-8-3-9-17-27)28(22-12-6-2-7-13-22)19-20-10-4-1-5-11-20/h1-2,4-7,10-15,18H,3,8-9,16-17,19H2
InChIKeyWSKXUDWTEGXNEB-UHFFFAOYSA-N
MW399.49 g/mol
LogP4.55
Rot. Bonds5

About N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide

N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide (PubChem CID 109081326) has the molecular formula C25H25N3O2 and a molecular weight of 399.49 g/mol. Its IUPAC name is N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide
PubChem CID109081326
Molecular FormulaC25H25N3O2
Molecular Weight399.49 g/mol
Exact Mass399.19
IUPAC NameN-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide
SMILESO=C(c1cc(C(=O)N(Cc2ccccc2)c2ccccc2)ccn1)N1CCCCC1
InChIInChI=1S/C25H25N3O2/c29-24(21-14-15-26-23(18-21)25(30)27-16-8-3-9-17-27)28(22-12-6-2-7-13-22)19-20-10-4-1-5-11-20/h1-2,4-7,10-15,18H,3,8-9,16-17,19H2
InChIKeyWSKXUDWTEGXNEB-UHFFFAOYSA-N
XLogP4.55
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.49
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-methyl-2-(pyrrolidine-1-carbonyl)pyridine-4-carboxamide
CID 109080522
4-(azepane-1-carbonyl)-N-benzyl-N-ethylpyridine-2-carboxamide
CID 109087072
N-benzyl-2-(pyrrolidine-1-carbonyl)pyridine-4-carboxamide
CID 109080517
[2-(azepane-1-carbonyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109080392
N-ethyl-2-(4-formylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide
CID 109084799
N-benzyl-N-methyl-2-(morpholine-4-carbonyl)pyridine-4-carboxamide
CID 109082965
2-(azepane-1-carbonyl)-N-(3-phenylpropyl)pyridine-4-carboxamide
CID 109089026
N-benzyl-2-fluoro-N-phenylpyridine-4-carboxamide
CID 52733507
N-(3-phenylpropyl)-2-(pyrrolidine-1-carbonyl)pyridine-4-carboxamide
CID 109080564
2-(azepan-1-yl)-N-benzyl-N-phenylpyrimidine-5-carboxamide
CID 109265025
N-methyl-2-(4-methylpiperazine-1-carbonyl)-N-phenylpyridine-4-carboxamide
CID 109084332
[2-(4-phenylpiperazine-1-carbonyl)-4-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109080358

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide?
The IUPAC name of N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide (CID 109081326) is N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide.
What is the SMILES notation for N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide?
The canonical SMILES for N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide is O=C(c1cc(C(=O)N(Cc2ccccc2)c2ccccc2)ccn1)N1CCCCC1.
What is the InChIKey of N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide?
The InChIKey is WSKXUDWTEGXNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O2/c29-24(21-14-15-26-23(18-21)25(30)27-16-8-3-9-17-27)28(22-12-6-2-7-13-22)19-20-10-4-1-5-11-20/h1-2,4-7,10-15,18H,3,8-9,16-17,19H2.
What are the key properties of N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide?
N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide has a molecular weight of 399.49 g/mol, XLogP of 4.55, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-phenyl-2-(piperidine-1-carbonyl)pyridine-4-carboxamide is sourced from PubChem (CID 109081326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).