(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide

C14H19ClN2O2 — CID 93359932

IUPAC(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide
SMILESCCOc1ccc(NC(=O)[C@H]2CCCCN2)cc1Cl
InChIInChI=1S/C14H19ClN2O2/c1-2-19-13-7-6-10(9-11(13)15)17-14(18)12-5-3-4-8-16-12/h6-7,9,12,16H,2-5,8H2,1H3,(H,17,18)/t12-/m1/s1
InChIKeySOZLBRXGHXKJDZ-GFCCVEGCSA-N
MW282.77 g/mol
LogP2.82
Rot. Bonds4

About (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide

(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide (PubChem CID 93359932) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide
PubChem CID93359932
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide
SMILESCCOc1ccc(NC(=O)[C@H]2CCCCN2)cc1Cl
InChIInChI=1S/C14H19ClN2O2/c1-2-19-13-7-6-10(9-11(13)15)17-14(18)12-5-3-4-8-16-12/h6-7,9,12,16H,2-5,8H2,1H3,(H,17,18)/t12-/m1/s1
InChIKeySOZLBRXGHXKJDZ-GFCCVEGCSA-N
XLogP2.82
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-ethoxyphenyl)azepane-2-carboxamide
CID 64564595
(2S)-N-(3-chloro-4-propoxyphenyl)pyrrolidine-2-carboxamide
CID 61179228
(2S)-N-(3-ethoxy-4-methoxyphenyl)piperidine-2-carboxamide
CID 103808938
N-(3-ethoxy-4-methoxyphenyl)piperidine-2-carboxamide
CID 43712591
(2S)-N-(3-ethoxy-4-methoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119717666
(2R)-N-(3-ethoxy-4-methoxyphenyl)pyrrolidine-2-carboxamide
CID 103795109
(2S)-N-[3-chloro-4-[2-(dimethylamino)ethoxy]phenyl]pyrrolidine-2-carboxamide
CID 122081630
N-(3-chloro-4-ethoxyphenyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119285013
(2S)-N-(3,4-dipropoxyphenyl)piperidine-2-carboxamide
CID 119679429
N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride
CID 42943662
(2R)-N-[3-chloro-4-(pyridin-3-ylmethoxy)phenyl]piperidine-2-carboxamide
CID 119846962
N-(3-chloro-4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119262099

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide?
The IUPAC name of (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide (CID 93359932) is (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide is CCOc1ccc(NC(=O)[C@H]2CCCCN2)cc1Cl.
What is the InChIKey of (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide?
The InChIKey is SOZLBRXGHXKJDZ-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-2-19-13-7-6-10(9-11(13)15)17-14(18)12-5-3-4-8-16-12/h6-7,9,12,16H,2-5,8H2,1H3,(H,17,18)/t12-/m1/s1.
What are the key properties of (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide?
(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide is sourced from PubChem (CID 93359932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).