N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide

C16H18N2O2 — CID 110683628

IUPACN-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide
SMILESCOCCCNC(=O)c1ccc(-c2ccccc2)nc1
InChIInChI=1S/C16H18N2O2/c1-20-11-5-10-17-16(19)14-8-9-15(18-12-14)13-6-3-2-4-7-13/h2-4,6-9,12H,5,10-11H2,1H3,(H,17,19)
InChIKeyQKKWNUAPRDPWST-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.51
Rot. Bonds6

About N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide

N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide (PubChem CID 110683628) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide
PubChem CID110683628
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide
SMILESCOCCCNC(=O)c1ccc(-c2ccccc2)nc1
InChIInChI=1S/C16H18N2O2/c1-20-11-5-10-17-16(19)14-8-9-15(18-12-14)13-6-3-2-4-7-13/h2-4,6-9,12H,5,10-11H2,1H3,(H,17,19)
InChIKeyQKKWNUAPRDPWST-UHFFFAOYSA-N
XLogP2.51
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 ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(6-phenylpyridine-3-carbonyl)amino]ethylcarbamic acid
CID 135122283
N-(3-methoxypropyl)-4-pyridin-2-ylbenzamide
CID 110464861
N-(3-methoxypropyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109153277
5-(4-methoxybutylcarbamoyl)pyridine-2-carboxylic acid
CID 60769978
N-[3-(2-methoxyethoxy)propyl]-4-phenylbenzamide
CID 134029636
N-[3-(2-methoxyethoxy)propyl]-6-phenoxypyridine-3-carboxamide
CID 87002549
N-(3-methoxypropyl)-4-(2-phenoxypyrimidin-5-yl)benzamide
CID 53116798
6-(2-fluoroanilino)-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109153355
6-phenyl-N-prop-2-enylpyridine-3-carboxamide
CID 110683620
N-(3-methoxypropyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109153274
6-(butylamino)-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109151550
N-(2-methoxyethyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109152988

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide?
The IUPAC name of N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide (CID 110683628) is N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide?
The canonical SMILES for N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide is COCCCNC(=O)c1ccc(-c2ccccc2)nc1.
What is the InChIKey of N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide?
The InChIKey is QKKWNUAPRDPWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-20-11-5-10-17-16(19)14-8-9-15(18-12-14)13-6-3-2-4-7-13/h2-4,6-9,12H,5,10-11H2,1H3,(H,17,19).
What are the key properties of N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide?
N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide has a molecular weight of 270.33 g/mol, XLogP of 2.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-6-phenylpyridine-3-carboxamide is sourced from PubChem (CID 110683628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).