N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide

C14H18F2N2O2 — CID 63130045

IUPACN-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide
SMILESCC1(C(=O)Nc2ccccc2OC(F)F)CCCNC1
InChIInChI=1S/C14H18F2N2O2/c1-14(7-4-8-17-9-14)12(19)18-10-5-2-3-6-11(10)20-13(15)16/h2-3,5-6,13,17H,4,7-9H2,1H3,(H,18,19)
InChIKeyBUKQDHJNYBHSPP-UHFFFAOYSA-N
MW284.31 g/mol
LogP2.62
Rot. Bonds4

About N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide

N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide (PubChem CID 63130045) has the molecular formula C14H18F2N2O2 and a molecular weight of 284.31 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide
PubChem CID63130045
Molecular FormulaC14H18F2N2O2
Molecular Weight284.31 g/mol
Exact Mass284.13
IUPAC NameN-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide
SMILESCC1(C(=O)Nc2ccccc2OC(F)F)CCCNC1
InChIInChI=1S/C14H18F2N2O2/c1-14(7-4-8-17-9-14)12(19)18-10-5-2-3-6-11(10)20-13(15)16/h2-3,5-6,13,17H,4,7-9H2,1H3,(H,18,19)
InChIKeyBUKQDHJNYBHSPP-UHFFFAOYSA-N
XLogP2.62
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[(3-methylpiperidine-3-carbonyl)amino]phenoxy]acetic acid
CID 63746531
N-[4-(difluoromethoxy)-3-fluorophenyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119944743
3-methyl-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide
CID 63132643
N-(4-fluoro-2-methoxyphenyl)-3-methylpiperidine-3-carboxamide
CID 55166819
3-methyl-N-[2-(2-methylpropoxy)phenyl]pyrrolidine-3-carboxamide
CID 63140356
3-methyl-N-(2-propylphenyl)piperidine-3-carboxamide
CID 63130513
N-[2-(2-methoxyethyl)phenyl]-3-methylpiperidine-3-carboxamide
CID 102905773
2,2-dichloro-N-[2-(difluoromethoxy)phenyl]-1-methylcyclopropane-1-carboxamide
CID 47135412
3-methyl-N-(2-methyl-3-pyridinyl)piperidine-3-carboxamide
CID 79043969
N-(2-methoxy-3-pyridinyl)-3-methylpiperidine-3-carboxamide
CID 63130698
3-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide;hydrochloride
CID 119943653
3-methyl-N-(2-propan-2-ylphenyl)pyrrolidine-3-carboxamide
CID 63141010

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide (CID 63130045) is N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide is CC1(C(=O)Nc2ccccc2OC(F)F)CCCNC1.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide?
The InChIKey is BUKQDHJNYBHSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O2/c1-14(7-4-8-17-9-14)12(19)18-10-5-2-3-6-11(10)20-13(15)16/h2-3,5-6,13,17H,4,7-9H2,1H3,(H,18,19).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide?
N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide has a molecular weight of 284.31 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-3-methylpiperidine-3-carboxamide is sourced from PubChem (CID 63130045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).