N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride

C14H27ClN2O3 — CID 119786670

IUPACN-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCOC1CCCCCC1)C1CNCCO1
InChIInChI=1S/C14H26N2O3.ClH/c17-14(13-11-15-7-9-19-13)16-8-10-18-12-5-3-1-2-4-6-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeyNJDJQARKHFMODB-UHFFFAOYSA-N
MW306.83 g/mol
LogP1.25
Rot. Bonds5

About N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride

N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119786670) has the molecular formula C14H27ClN2O3 and a molecular weight of 306.83 g/mol. Its IUPAC name is N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119786670
Molecular FormulaC14H27ClN2O3
Molecular Weight306.83 g/mol
Exact Mass306.17
IUPAC NameN-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NCCOC1CCCCCC1)C1CNCCO1
InChIInChI=1S/C14H26N2O3.ClH/c17-14(13-11-15-7-9-19-13)16-8-10-18-12-5-3-1-2-4-6-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeyNJDJQARKHFMODB-UHFFFAOYSA-N
XLogP1.25
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.83
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-cyclohexylpropyl)morpholine-2-carboxamide;hydrochloride
CID 119724280
(2S)-N-(2-piperidin-4-yloxyethyl)oxolane-2-carboxamide
CID 104856278
2-(morpholine-2-carbonylamino)ethyl carbamate
CID 83210560
N-[2-(cyclopropanecarbonylamino)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119687765
N-[2-(cyclopropylmethoxy)ethyl]morpholine-2-carboxamide
CID 103809948
N-[3-(cyclohexylamino)-3-oxopropyl]morpholine-2-carboxamide;hydrochloride
CID 119741950
(2S)-N-(cyclobutylmethyl)morpholine-2-carboxamide;hydrochloride
CID 131065842
(2R,5S)-5-(2-cyclohexyloxyethylcarbamoyl)oxolane-2-carboxylic acid
CID 102945281
N-(3-cyclopentylpropyl)morpholine-2-carboxamide
CID 113266264
2-[2-(morpholine-2-carbonylamino)ethoxy]acetic acid
CID 79457958
N-(5-piperidin-1-ylpentyl)morpholine-2-carboxamide;dihydrochloride
CID 119885469
N-(2-cyclopentyloxyethyl)piperidine-4-carboxamide
CID 63828643

Frequently Asked Questions

What is the IUPAC name of N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride (CID 119786670) is N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride is Cl.O=C(NCCOC1CCCCCC1)C1CNCCO1.
What is the InChIKey of N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is NJDJQARKHFMODB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3.ClH/c17-14(13-11-15-7-9-19-13)16-8-10-18-12-5-3-1-2-4-6-12;/h12-13,15H,1-11H2,(H,16,17);1H.
What are the key properties of N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride?
N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 306.83 g/mol, XLogP of 1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cycloheptyloxyethyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119786670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).