N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide

C16H18N2O2 — CID 52615794

IUPACN-(6-methoxy-3-pyridinyl)-4-phenylbutanamide
SMILESCOc1ccc(NC(=O)CCCc2ccccc2)cn1
InChIInChI=1S/C16H18N2O2/c1-20-16-11-10-14(12-17-16)18-15(19)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,18,19)
InChIKeyBNTOWWNKQNLJQB-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.05
Rot. Bonds6

About N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide

N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide (PubChem CID 52615794) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-4-phenylbutanamide
PubChem CID52615794
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(6-methoxy-3-pyridinyl)-4-phenylbutanamide
SMILESCOc1ccc(NC(=O)CCCc2ccccc2)cn1
InChIInChI=1S/C16H18N2O2/c1-20-16-11-10-14(12-17-16)18-15(19)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,18,19)
InChIKeyBNTOWWNKQNLJQB-UHFFFAOYSA-N
XLogP3.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-fluoro-3-pyridinyl)-4-phenylbutanamide
CID 103789587
4-(1,3-benzothiazol-2-yl)-N-(6-methoxy-3-pyridinyl)butanamide
CID 2472699
N-(3-methoxyphenyl)-4-phenylbutanamide
CID 683926
3-[(4R)-2,5-dioxo-1-(2-phenylethyl)imidazolidin-4-yl]-N-(6-methoxy-3-pyridinyl)propanamide
CID 124862824
3-(1H-benzimidazol-2-yl)-N-(6-methoxy-3-pyridinyl)propanamide
CID 44773909
N-(6-methoxy-3-pyridinyl)-2-phenylsulfanylacetamide
CID 2486887
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
3-acetamido-N-(6-methoxy-3-pyridinyl)propanamide
CID 47096905
2-(2-methoxyphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 2677021
4-(4-methoxyphenyl)-N-phenylbutanamide
CID 48980411
2-(2-aminophenyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 16795634
N-[4-(4-oxopentyl)phenyl]-4-phenylbutanamide
CID 21335633

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide (CID 52615794) is N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide is COc1ccc(NC(=O)CCCc2ccccc2)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide?
The InChIKey is BNTOWWNKQNLJQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-20-16-11-10-14(12-17-16)18-15(19)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,18,19).
What are the key properties of N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide?
N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide has a molecular weight of 270.33 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-4-phenylbutanamide is sourced from PubChem (CID 52615794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).