N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide

C17H26N2O2 — CID 119301760

IUPACN-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide
SMILESCc1cccc(C)c1OCC(C)NC(=O)C1CCCCN1
InChIInChI=1S/C17H26N2O2/c1-12-7-6-8-13(2)16(12)21-11-14(3)19-17(20)15-9-4-5-10-18-15/h6-8,14-15,18H,4-5,9-11H2,1-3H3,(H,19,20)
InChIKeyNATFJIYTBZZBTG-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.33
Rot. Bonds5

About N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide

N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide (PubChem CID 119301760) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide
PubChem CID119301760
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide
SMILESCc1cccc(C)c1OCC(C)NC(=O)C1CCCCN1
InChIInChI=1S/C17H26N2O2/c1-12-7-6-8-13(2)16(12)21-11-14(3)19-17(20)15-9-4-5-10-18-15/h6-8,14-15,18H,4-5,9-11H2,1-3H3,(H,19,20)
InChIKeyNATFJIYTBZZBTG-UHFFFAOYSA-N
XLogP2.33
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-2-carboxamide
CID 103809635
N-[1-(2,6-dimethylphenoxy)propan-2-yl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119301757
(2S)-N-[(2S)-1-(3-fluorophenoxy)propan-2-yl]piperidine-2-carboxamide
CID 97235197
N-[1-(3-methylphenoxy)propan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 119300007
2-[1-(2,6-dimethylphenoxy)propan-2-ylcarbamoyl]cyclobutane-1-carboxylic acid
CID 120975441
N-[1-(2,4-difluorophenoxy)propan-2-yl]piperidine-2-carboxamide;hydrochloride
CID 119299959
3-amino-N-[1-(2,6-dimethylphenoxy)propan-2-yl]cyclohexane-1-carboxamide;hydrochloride
CID 119745976
N-(5-methylhexan-2-yl)piperidine-2-carboxamide
CID 43579330
N-(4-phenylbutan-2-yl)piperidine-2-carboxamide;hydrochloride
CID 119262921
N-[1-(2,4-dimethylphenyl)propan-2-yl]piperidine-2-carboxamide;hydrochloride
CID 119321004
(2R)-N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-2-carboxamide
CID 103808999
N-[1-(2-methoxyphenyl)propan-2-yl]piperidine-2-carboxamide
CID 60927015

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide?
The IUPAC name of N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide (CID 119301760) is N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide.
What is the SMILES notation for N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide?
The canonical SMILES for N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide is Cc1cccc(C)c1OCC(C)NC(=O)C1CCCCN1.
What is the InChIKey of N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide?
The InChIKey is NATFJIYTBZZBTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-12-7-6-8-13(2)16(12)21-11-14(3)19-17(20)15-9-4-5-10-18-15/h6-8,14-15,18H,4-5,9-11H2,1-3H3,(H,19,20).
What are the key properties of N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide?
N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,6-dimethylphenoxy)propan-2-yl]piperidine-2-carboxamide is sourced from PubChem (CID 119301760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).