2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide

C25H26N4O2 — CID 55858991

IUPAC2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
SMILESO=C(Nc1ccccc1C(=O)NC1CCN(Cc2ccccn2)CC1)c1ccccc1
InChIInChI=1S/C25H26N4O2/c30-24(19-8-2-1-3-9-19)28-23-12-5-4-11-22(23)25(31)27-20-13-16-29(17-14-20)18-21-10-6-7-15-26-21/h1-12,15,20H,13-14,16-18H2,(H,27,31)(H,28,30)
InChIKeyPCTPCFMDSUYSAG-UHFFFAOYSA-N
MW414.51 g/mol
LogP3.73
Rot. Bonds6

About 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide

2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide (PubChem CID 55858991) has the molecular formula C25H26N4O2 and a molecular weight of 414.51 g/mol. Its IUPAC name is 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
PubChem CID55858991
Molecular FormulaC25H26N4O2
Molecular Weight414.51 g/mol
Exact Mass414.21
IUPAC Name2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
SMILESO=C(Nc1ccccc1C(=O)NC1CCN(Cc2ccccn2)CC1)c1ccccc1
InChIInChI=1S/C25H26N4O2/c30-24(19-8-2-1-3-9-19)28-23-12-5-4-11-22(23)25(31)27-20-13-16-29(17-14-20)18-21-10-6-7-15-26-21/h1-12,15,20H,13-14,16-18H2,(H,27,31)(H,28,30)
InChIKeyPCTPCFMDSUYSAG-UHFFFAOYSA-N
XLogP3.73
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]cyclopropanecarboxamide
CID 37476276
2,4-dichloro-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
CID 47058964
N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-2-(trifluoromethylsulfonyl)pyridine-3-carboxamide
CID 56504110
4-(2-methylpropanoylamino)-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
CID 55858736
[1-(pyridin-2-ylmethyl)piperidin-4-yl]urea;dihydrochloride
CID 174440638
N-[[1-(pyridin-2-ylmethyl)piperidin-4-yl]methyl]benzamide
CID 16896080
4-(difluoromethoxy)-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
CID 47058915
4-(4-methylpiperidin-1-yl)-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
CID 46977137
N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]thiophene-2-carboxamide
CID 51087555
4-propan-2-ylsulfonyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide
CID 55858737
2-benzamido-N-piperidin-4-ylbenzamide
CID 119388442
2-benzamido-N-[1-[(3-fluoro-4-methoxyphenyl)methyl]piperidin-4-yl]benzamide
CID 55959028

Frequently Asked Questions

What is the IUPAC name of 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide (CID 55858991) is 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide is O=C(Nc1ccccc1C(=O)NC1CCN(Cc2ccccn2)CC1)c1ccccc1.
What is the InChIKey of 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide?
The InChIKey is PCTPCFMDSUYSAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O2/c30-24(19-8-2-1-3-9-19)28-23-12-5-4-11-22(23)25(31)27-20-13-16-29(17-14-20)18-21-10-6-7-15-26-21/h1-12,15,20H,13-14,16-18H2,(H,27,31)(H,28,30).
What are the key properties of 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide?
2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide has a molecular weight of 414.51 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzamido-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 55858991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).