(2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide

C15H22N2O3 — CID 103808409

IUPAC(2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide
SMILESCOc1ccc(OC)c(CNC(=O)[C@H]2CCCCN2)c1
InChIInChI=1S/C15H22N2O3/c1-19-12-6-7-14(20-2)11(9-12)10-17-15(18)13-5-3-4-8-16-13/h6-7,9,13,16H,3-5,8,10H2,1-2H3,(H,17,18)/t13-/m1/s1
InChIKeyPYXLQRGOCJJSEY-CYBMUJFWSA-N
MW278.35 g/mol
LogP1.46
Rot. Bonds5

About (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide

(2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide (PubChem CID 103808409) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide
PubChem CID103808409
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name(2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide
SMILESCOc1ccc(OC)c(CNC(=O)[C@H]2CCCCN2)c1
InChIInChI=1S/C15H22N2O3/c1-19-12-6-7-14(20-2)11(9-12)10-17-15(18)13-5-3-4-8-16-13/h6-7,9,13,16H,3-5,8,10H2,1-2H3,(H,17,18)/t13-/m1/s1
InChIKeyPYXLQRGOCJJSEY-CYBMUJFWSA-N
XLogP1.46
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,4-dimethoxyphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119279585
N-[(5-chloro-2-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119296053
N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119334414
N-[(3,4-dimethoxyphenyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119263557
N-[(2,5-dimethoxyphenyl)methyl]-2-methylpiperidine-4-carboxamide
CID 106739773
N-[(2,5-dimethoxyphenyl)methyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119278469
N-[2-(2,4-dimethoxyphenyl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119302405
(3S)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-3-carboxamide
CID 81140138
N-[(2-bromo-4,5-dimethoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 119316734
(2S)-N-[(3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 50944119
N-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-2-carboxamide;hydrochloride
CID 119263802
(2S)-N-[(3-methoxy-4-methylphenyl)methyl]pyrrolidine-2-carboxamide
CID 166226032

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide?
The IUPAC name of (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide (CID 103808409) is (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide is COc1ccc(OC)c(CNC(=O)[C@H]2CCCCN2)c1.
What is the InChIKey of (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide?
The InChIKey is PYXLQRGOCJJSEY-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-19-12-6-7-14(20-2)11(9-12)10-17-15(18)13-5-3-4-8-16-13/h6-7,9,13,16H,3-5,8,10H2,1-2H3,(H,17,18)/t13-/m1/s1.
What are the key properties of (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide?
(2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2,5-dimethoxyphenyl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 103808409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).