(2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide

C16H24N2O2 — CID 103809566

IUPAC(2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
SMILESCCOc1ccccc1CN(C)C(=O)[C@H]1CCCCN1
InChIInChI=1S/C16H24N2O2/c1-3-20-15-10-5-4-8-13(15)12-18(2)16(19)14-9-6-7-11-17-14/h4-5,8,10,14,17H,3,6-7,9,11-12H2,1-2H3/t14-/m1/s1
InChIKeyUZWWOJBMYLGRBP-CQSZACIVSA-N
MW276.38 g/mol
LogP2.19
Rot. Bonds5

About (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide

(2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide (PubChem CID 103809566) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
PubChem CID103809566
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name(2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
SMILESCCOc1ccccc1CN(C)C(=O)[C@H]1CCCCN1
InChIInChI=1S/C16H24N2O2/c1-3-20-15-10-5-4-8-13(15)12-18(2)16(19)14-9-6-7-11-17-14/h4-5,8,10,14,17H,3,6-7,9,11-12H2,1-2H3/t14-/m1/s1
InChIKeyUZWWOJBMYLGRBP-CQSZACIVSA-N
XLogP2.19
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide
CID 63005308
N-[(2-chlorophenyl)methyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119267602
(2R)-N-methyl-N-[(2-methylphenyl)methyl]pyrrolidine-2-carboxamide
CID 93042188
N-[(2-fluorophenyl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 42890905
N-[(2-chlorophenyl)methyl]-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 119267609
(2R)-N-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 124685551
N-methyl-N-[3-(2-methylphenoxy)propyl]piperidine-2-carboxamide
CID 119298328
(2S)-N-benzyl-N-methylpyrrolidine-2-carboxamide
CID 22691346
(2S)-N-[2-(2-chlorophenoxy)ethyl]-N-methylpiperidine-2-carboxamide;hydrochloride
CID 119695444
3-amino-N-[(2-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119738433
(2R)-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide
CID 103808029
(2R)-N-methyl-N-(naphthalen-2-ylmethyl)piperidine-2-carboxamide
CID 103808154

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide?
The IUPAC name of (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide (CID 103809566) is (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide?
The canonical SMILES for (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide is CCOc1ccccc1CN(C)C(=O)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide?
The InChIKey is UZWWOJBMYLGRBP-CQSZACIVSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-20-15-10-5-4-8-13(15)12-18(2)16(19)14-9-6-7-11-17-14/h4-5,8,10,14,17H,3,6-7,9,11-12H2,1-2H3/t14-/m1/s1.
What are the key properties of (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide?
(2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2-ethoxyphenyl)methyl]-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 103809566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).