4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide

C17H18N2O2 — CID 154794734

IUPAC4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(C3CC3)cc2C)ccn1
InChIInChI=1S/C17H18N2O2/c1-11-9-13(12-3-4-12)5-6-16(11)21-14-7-8-19-15(10-14)17(20)18-2/h5-10,12H,3-4H2,1-2H3,(H,18,20)
InChIKeyQAWOBNZIOOUINK-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.42
Rot. Bonds4

About 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide

4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide (PubChem CID 154794734) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide
PubChem CID154794734
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1cc(Oc2ccc(C3CC3)cc2C)ccn1
InChIInChI=1S/C17H18N2O2/c1-11-9-13(12-3-4-12)5-6-16(11)21-14-7-8-19-15(10-14)17(20)18-2/h5-10,12H,3-4H2,1-2H3,(H,18,20)
InChIKeyQAWOBNZIOOUINK-UHFFFAOYSA-N
XLogP3.42
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-4-[[2-(methylcarbamoyl)-4-pyridinyl]oxy]benzoic acid
CID 107672806
N-methyl-4-[2-methyl-4-[[4-methyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]pyridine-2-carboxamide
CID 142963034
4-[4-[[(2-methoxy-4,5-dimethylphenyl)carbamoylamino]methyl]-2-methylphenoxy]-N-methylpyridine-2-carboxamide
CID 118301640
4-(5-hydrazinyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide
CID 86069287
4-(4-amino-3-methylphenoxy)-N-methylpyridine-2-carboxamide;hydrochloride
CID 66746840
N-methyl-4-[2-methyl-5-(pyrrolidine-3-carbonylamino)phenoxy]pyridine-2-carboxamide
CID 119893257
4-[4-[1-(difluoromethyl)pyrazol-4-yl]-2-methylphenoxy]-N-methylpyridine-2-carboxamide
CID 166373863
4-[5-[(3-aminobicyclo[2.2.1]heptane-2-carbonyl)amino]-2-methylphenoxy]-N-methylpyridine-2-carboxamide
CID 119893225
4-[5-[(3-aminobicyclo[2.2.1]heptane-2-carbonyl)amino]-2-methylphenoxy]-N-methylpyridine-2-carboxamide;dihydrochloride
CID 119893224
4-[2-(hydroxymethyl)phenoxy]-N-methylpyridine-2-carboxamide
CID 107713393
4-(4-aminocyclohexa-1,3-dien-1-yl)oxy-N-methylpyridine-2-carboxamide
CID 163446096
4-[5-[(3-aminocyclopentanecarbonyl)amino]-2-methylphenoxy]-N-methylpyridine-2-carboxamide
CID 119893223

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide (CID 154794734) is 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide is CNC(=O)c1cc(Oc2ccc(C3CC3)cc2C)ccn1.
What is the InChIKey of 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide?
The InChIKey is QAWOBNZIOOUINK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-11-9-13(12-3-4-12)5-6-16(11)21-14-7-8-19-15(10-14)17(20)18-2/h5-10,12H,3-4H2,1-2H3,(H,18,20).
What are the key properties of 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide?
4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopropyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 154794734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).