N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide

C16H18N2O2 — CID 110442879

IUPACN-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide
SMILESCOc1ccc(C(C)(C)NC(=O)c2cccnc2)cc1
InChIInChI=1S/C16H18N2O2/c1-16(2,13-6-8-14(20-3)9-7-13)18-15(19)12-5-4-10-17-11-12/h4-11H,1-3H3,(H,18,19)
InChIKeyORYNJQHZUPUTKO-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.76
Rot. Bonds4

About N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide

N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide (PubChem CID 110442879) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide
PubChem CID110442879
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide
SMILESCOc1ccc(C(C)(C)NC(=O)c2cccnc2)cc1
InChIInChI=1S/C16H18N2O2/c1-16(2,13-6-8-14(20-3)9-7-13)18-15(19)12-5-4-10-17-11-12/h4-11H,1-3H3,(H,18,19)
InChIKeyORYNJQHZUPUTKO-UHFFFAOYSA-N
XLogP2.76
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-4-carboxamide
CID 110444865
N-(2-phenylpropan-2-yl)pyridine-3-carboxamide
CID 47444755
N-(2-pyridin-3-ylpropan-2-yl)pyridine-3-carboxamide
CID 110870312
4-acetamido-N-[2-(4-methoxyphenyl)propan-2-yl]benzamide
CID 110445289
N'-[1-(4-methoxyphenyl)ethenyl]pyridine-3-carbohydrazide
CID 4744370
N-[2-(4-methoxyphenyl)propan-2-yl]-3H-benzimidazole-5-carboxamide
CID 110444797
2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-2-(pyridine-3-carbonylamino)propanoic acid
CID 67325962
N-[2-(4-methoxyphenyl)propan-2-yl]-2H-triazole-4-carboxamide
CID 110475495
N-[2-(4-methoxyphenyl)propan-2-yl]-4-(2-methylpropoxy)benzamide
CID 110440877
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 47178927
N-[(Z)-1-(4-methoxyphenyl)propylideneamino]pyridine-3-carboxamide
CID 6062098
N-[2-(4-methoxyphenyl)propan-2-yl]-1-methylimidazole-2-carboxamide
CID 110467375

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide?
The IUPAC name of N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide (CID 110442879) is N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide is COc1ccc(C(C)(C)NC(=O)c2cccnc2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide?
The InChIKey is ORYNJQHZUPUTKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-16(2,13-6-8-14(20-3)9-7-13)18-15(19)12-5-4-10-17-11-12/h4-11H,1-3H3,(H,18,19).
What are the key properties of N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide?
N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide has a molecular weight of 270.33 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 110442879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).