N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide

C21H20N2O2 — CID 60605870

IUPACN-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)/N=c2\ccccn2Cc2ccccc2)cc1
InChIInChI=1S/C21H20N2O2/c1-25-19-12-10-17(11-13-19)15-21(24)22-20-9-5-6-14-23(20)16-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3/b22-20+
InChIKeyBAIRNFXZQXADNF-LSDHQDQOSA-N
MW332.40 g/mol
LogP3.21
Rot. Bonds5

About N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide

N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide (PubChem CID 60605870) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide
PubChem CID60605870
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC NameN-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)/N=c2\ccccn2Cc2ccccc2)cc1
InChIInChI=1S/C21H20N2O2/c1-25-19-12-10-17(11-13-19)15-21(24)22-20-9-5-6-14-23(20)16-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3/b22-20+
InChIKeyBAIRNFXZQXADNF-LSDHQDQOSA-N
XLogP3.21
TPSA43.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-benzyl-2-pyridinylidene)-3-(3-methoxyphenyl)propanamide
CID 43035260
N-(1-benzyl-2-oxo-3-pyridinyl)-2-(4-methoxyphenyl)acetamide
CID 71921771
2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[1-[(4-methylphenyl)methyl]-2-pyridinylidene]acetamide
CID 45354054
[[1-amino-2-(4-methoxyphenyl)ethylidene]amino] 2-phenylacetate
CID 3130761
N-(1-benzyl-2-pyridinylidene)-3,5-dimethylbenzamide
CID 60584634
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 126150640
3-chloro-1-[(4-methoxyphenyl)methyl]pyridin-2-one
CID 141379797
1-(4-benzyl-3,5-dimethylpiperazin-1-yl)-2-(4-methoxyphenyl)ethanone
CID 110393885
N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)-2-(4-methoxyphenyl)acetamide
CID 40700280
(NE)-N-[1-(4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
CID 10060245
1,2-dibenzyl-4-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3,5-dione
CID 166447403

Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide (CID 60605870) is N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)/N=c2\ccccn2Cc2ccccc2)cc1.
What is the InChIKey of N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide?
The InChIKey is BAIRNFXZQXADNF-LSDHQDQOSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-25-19-12-10-17(11-13-19)15-21(24)22-20-9-5-6-14-23(20)16-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3/b22-20+.
What are the key properties of N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide?
N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide has a molecular weight of 332.40 g/mol, XLogP of 3.21, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-2-pyridinylidene)-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 60605870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).