N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide

C26H23N5O2 — CID 25153718

IUPACN-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide
SMILESNc1ccc(-c2ccccc2)nc1NC(=O)c1ccc(CNC(=O)Cc2ccccn2)cc1
InChIInChI=1S/C26H23N5O2/c27-22-13-14-23(19-6-2-1-3-7-19)30-25(22)31-26(33)20-11-9-18(10-12-20)17-29-24(32)16-21-8-4-5-15-28-21/h1-15H,16-17,27H2,(H,29,32)(H,30,31,33)
InChIKeyZNSZPPQMYRBQKF-UHFFFAOYSA-N
MW437.50 g/mol
LogP3.84
Rot. Bonds7

About N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide

N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide (PubChem CID 25153718) has the molecular formula C26H23N5O2 and a molecular weight of 437.50 g/mol. Its IUPAC name is N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide
PubChem CID25153718
Molecular FormulaC26H23N5O2
Molecular Weight437.50 g/mol
Exact Mass437.19
IUPAC NameN-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide
SMILESNc1ccc(-c2ccccc2)nc1NC(=O)c1ccc(CNC(=O)Cc2ccccn2)cc1
InChIInChI=1S/C26H23N5O2/c27-22-13-14-23(19-6-2-1-3-7-19)30-25(22)31-26(33)20-11-9-18(10-12-20)17-29-24(32)16-21-8-4-5-15-28-21/h1-15H,16-17,27H2,(H,29,32)(H,30,31,33)
InChIKeyZNSZPPQMYRBQKF-UHFFFAOYSA-N
XLogP3.84
TPSA110.00 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.50
LogP ≤ 53.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide with MolForge

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Related Compounds

pyridin-2-ylmethyl N-[[4-[(3-amino-6-phenyl-2-pyridinyl)carbamoyl]phenyl]methyl]carbamate
CID 25153921
N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-4-ylacetyl)amino]methyl]benzamide
CID 25153720
[4-[(3-amino-6-phenyl-2-pyridinyl)carbamoyl]phenyl]methyl-(pyridin-2-ylmethyl)carbamic acid
CID 68779859
tert-butyl N-[[4-[(3-amino-6-phenyl-2-pyridinyl)carbamoyl]phenyl]methyl]carbamate
CID 25150915
N-(3-amino-6-phenyl-2-pyridinyl)-4-[(1-methoxypropan-2-ylamino)methyl]benzamide
CID 25153925
N-(3-amino-6-phenyl-2-pyridinyl)-4-[(2-methoxypropylamino)methyl]benzamide
CID 68727277
[4-[(3-amino-6-phenyl-2-pyridinyl)carbamoyl]phenyl]methyl-propan-2-ylcarbamic acid
CID 68783766
[4-[(3-amino-6-phenyl-2-pyridinyl)carbamoyl]phenyl]methyl-(pyridin-3-ylmethyl)carbamic acid
CID 68723870
N-(3-amino-6-phenyl-2-pyridinyl)pyrimidine-5-carboxamide
CID 146525533
N-[(3-phenyl-1H-1,2,4-triazol-5-yl)methyl]-2-pyridin-2-ylacetamide
CID 77083716
N-(2-aminophenyl)-4-[[(2-phenylacetyl)amino]methyl]benzamide
CID 11348920
N-(2-amino-5-phenylphenyl)-4-[(2-methylpropanoylamino)methyl]benzamide
CID 25156529

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide?
The IUPAC name of N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide (CID 25153718) is N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide.
What is the SMILES notation for N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide?
The canonical SMILES for N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide is Nc1ccc(-c2ccccc2)nc1NC(=O)c1ccc(CNC(=O)Cc2ccccn2)cc1.
What is the InChIKey of N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide?
The InChIKey is ZNSZPPQMYRBQKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N5O2/c27-22-13-14-23(19-6-2-1-3-7-19)30-25(22)31-26(33)20-11-9-18(10-12-20)17-29-24(32)16-21-8-4-5-15-28-21/h1-15H,16-17,27H2,(H,29,32)(H,30,31,33).
What are the key properties of N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide?
N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide has a molecular weight of 437.50 g/mol, XLogP of 3.84, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-6-phenyl-2-pyridinyl)-4-[[(2-pyridin-2-ylacetyl)amino]methyl]benzamide is sourced from PubChem (CID 25153718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).