N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide

C20H27ClN2O2 — CID 55610194

IUPACN-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide
SMILESO=C(NCC(c1ccccc1Cl)N1CCOCC1)C1CC2CCC1C2
InChIInChI=1S/C20H27ClN2O2/c21-18-4-2-1-3-16(18)19(23-7-9-25-10-8-23)13-22-20(24)17-12-14-5-6-15(17)11-14/h1-4,14-15,17,19H,5-13H2,(H,22,24)
InChIKeyWSEHWFNVYDCGLQ-UHFFFAOYSA-N
MW362.90 g/mol
LogP3.27
Rot. Bonds5

About N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide

N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 55610194) has the molecular formula C20H27ClN2O2 and a molecular weight of 362.90 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide
PubChem CID55610194
Molecular FormulaC20H27ClN2O2
Molecular Weight362.90 g/mol
Exact Mass362.18
IUPAC NameN-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide
SMILESO=C(NCC(c1ccccc1Cl)N1CCOCC1)C1CC2CCC1C2
InChIInChI=1S/C20H27ClN2O2/c21-18-4-2-1-3-16(18)19(23-7-9-25-10-8-23)13-22-20(24)17-12-14-5-6-15(17)11-14/h1-4,14-15,17,19H,5-13H2,(H,22,24)
InChIKeyWSEHWFNVYDCGLQ-UHFFFAOYSA-N
XLogP3.27
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.90
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bicyclo[2.2.1]heptanyl)-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]acetamide
CID 46412316
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119849610
(2S,4R)-N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-4-hydroxypyrrolidine-2-carboxamide
CID 124701792
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]piperidine-2-carboxamide;dihydrochloride
CID 119849605
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-2,2-dimethylpropanamide
CID 37054001
2-amino-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]acetamide;dihydrochloride
CID 119849627
ethyl N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]carbamate
CID 110314125
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide
CID 55635533
N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pyridine-4-carboxamide
CID 37050347
N-[(2R)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide
CID 37050457
N-[(2S)-2-(2-chlorophenyl)-2-morpholin-4-ylethyl]pentanamide
CID 35041740
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-4-pyrrol-1-ylbenzamide
CID 55609911

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide (CID 55610194) is N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide is O=C(NCC(c1ccccc1Cl)N1CCOCC1)C1CC2CCC1C2.
What is the InChIKey of N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is WSEHWFNVYDCGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27ClN2O2/c21-18-4-2-1-3-16(18)19(23-7-9-25-10-8-23)13-22-20(24)17-12-14-5-6-15(17)11-14/h1-4,14-15,17,19H,5-13H2,(H,22,24).
What are the key properties of N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide?
N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 362.90 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]bicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 55610194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).