6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide

C14H18F2N2O3 — CID 136564767

IUPAC6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
SMILESCN(CC1CCOCC1)C(=O)c1ccc(OC(F)F)nc1
InChIInChI=1S/C14H18F2N2O3/c1-18(9-10-4-6-20-7-5-10)13(19)11-2-3-12(17-8-11)21-14(15)16/h2-3,8,10,14H,4-7,9H2,1H3
InChIKeyRPRZOUWVSGKPHX-UHFFFAOYSA-N
MW300.30 g/mol
LogP2.18
Rot. Bonds5

About 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide

6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 136564767) has the molecular formula C14H18F2N2O3 and a molecular weight of 300.30 g/mol. Its IUPAC name is 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
PubChem CID136564767
Molecular FormulaC14H18F2N2O3
Molecular Weight300.30 g/mol
Exact Mass300.13
IUPAC Name6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
SMILESCN(CC1CCOCC1)C(=O)c1ccc(OC(F)F)nc1
InChIInChI=1S/C14H18F2N2O3/c1-18(9-10-4-6-20-7-5-10)13(19)11-2-3-12(17-8-11)21-14(15)16/h2-3,8,10,14H,4-7,9H2,1H3
InChIKeyRPRZOUWVSGKPHX-UHFFFAOYSA-N
XLogP2.18
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.30
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-6-(oxan-4-ylmethoxy)pyridine-3-carboxamide
CID 91815390
6-(difluoromethoxy)-N-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)pyridine-3-carboxamide
CID 138026866
4-amino-N-methyl-N-(oxan-4-ylmethyl)benzamide
CID 63725878
2-hydrazinyl-N-methyl-N-(oxan-4-ylmethyl)pyridine-4-carboxamide
CID 55228397
6-amino-5-chloro-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
CID 63707112
4-amino-3-fluoro-N-methyl-N-(oxan-4-ylmethyl)benzamide
CID 63726052
5-cyano-N-methyl-N-(oxan-4-ylmethyl)pyridine-2-carboxamide
CID 63770699
N-(cyclopropylmethyl)-N-methyl-6-(methylamino)pyridine-3-carboxamide
CID 62179892
N-(cyclohexylmethyl)-N,6-dimethylpyridine-3-carboxamide
CID 39975112
2-fluoro-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
CID 114037709
3-amino-N-methyl-N-(oxan-4-ylmethyl)pyridine-2-carboxamide
CID 104742327
N-(cyclopropylmethyl)-6-(ethylamino)-N-methylpyridine-3-carboxamide
CID 62180065

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide (CID 136564767) is 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide is CN(CC1CCOCC1)C(=O)c1ccc(OC(F)F)nc1.
What is the InChIKey of 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is RPRZOUWVSGKPHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O3/c1-18(9-10-4-6-20-7-5-10)13(19)11-2-3-12(17-8-11)21-14(15)16/h2-3,8,10,14H,4-7,9H2,1H3.
What are the key properties of 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide?
6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 300.30 g/mol, XLogP of 2.18, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethoxy)-N-methyl-N-(oxan-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 136564767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).