N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide

C16H24N2O2 — CID 110462338

IUPACN-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide
SMILESCC(C)(C)Oc1ccc(NC(=O)C2CCCCN2)cc1
InChIInChI=1S/C16H24N2O2/c1-16(2,3)20-13-9-7-12(8-10-13)18-15(19)14-6-4-5-11-17-14/h7-10,14,17H,4-6,11H2,1-3H3,(H,18,19)
InChIKeyLHEDKUYCUCGUBZ-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.94
Rot. Bonds3

About N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide

N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide (PubChem CID 110462338) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide
PubChem CID110462338
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide
SMILESCC(C)(C)Oc1ccc(NC(=O)C2CCCCN2)cc1
InChIInChI=1S/C16H24N2O2/c1-16(2,3)20-13-9-7-12(8-10-13)18-15(19)14-6-4-5-11-17-14/h7-10,14,17H,4-6,11H2,1-3H3,(H,18,19)
InChIKeyLHEDKUYCUCGUBZ-UHFFFAOYSA-N
XLogP2.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 56832268
N-[4-(2-methoxyethoxy)phenyl]piperidine-2-carboxamide
CID 43713427
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119670939
(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119671696
(2S)-N-[4-(2-methylpropanoylamino)phenyl]piperidine-2-carboxamide
CID 103808067
N-(4-tert-butylsulfanylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119315492
2-[4-[[(2R)-piperidine-2-carbonyl]amino]phenoxy]acetic acid
CID 104913965
(2R)-N-[4-(2,2,2-trifluoroethoxy)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119698605
(2S)-N-(4-acetamidophenyl)pyrrolidine-2-carboxamide
CID 22691413
(2R)-N-[4-(tert-butylcarbamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119703073
N-[4-(methanesulfonamido)phenyl]piperidine-2-carboxamide
CID 43709925
N-[4-(4-methylsulfonylphenoxy)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119315410

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide?
The IUPAC name of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide (CID 110462338) is N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide?
The canonical SMILES for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide is CC(C)(C)Oc1ccc(NC(=O)C2CCCCN2)cc1.
What is the InChIKey of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide?
The InChIKey is LHEDKUYCUCGUBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-16(2,3)20-13-9-7-12(8-10-13)18-15(19)14-6-4-5-11-17-14/h7-10,14,17H,4-6,11H2,1-3H3,(H,18,19).
What are the key properties of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide?
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide is sourced from PubChem (CID 110462338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).