N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride

C14H27ClN2O2 — CID 119741853

IUPACN-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCCCCC1)C1COCCN1
InChIInChI=1S/C14H26N2O2.ClH/c17-14(13-11-18-9-8-15-13)16-10-12-6-4-2-1-3-5-7-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeyDLJAEIOLWCAHIP-UHFFFAOYSA-N
MW290.84 g/mol
LogP1.87
Rot. Bonds3

About N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride

N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119741853) has the molecular formula C14H27ClN2O2 and a molecular weight of 290.84 g/mol. Its IUPAC name is N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
PubChem CID119741853
Molecular FormulaC14H27ClN2O2
Molecular Weight290.84 g/mol
Exact Mass290.18
IUPAC NameN-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCCCCC1)C1COCCN1
InChIInChI=1S/C14H26N2O2.ClH/c17-14(13-11-18-9-8-15-13)16-10-12-6-4-2-1-3-5-7-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeyDLJAEIOLWCAHIP-UHFFFAOYSA-N
XLogP1.87
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.84
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylcyclohexyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119750252
N-(cyclooctylmethyl)piperidine-2-carboxamide;hydrochloride
CID 119299438
N-[2-(cyclobutylmethylsulfamoyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119782528
N-(oxan-4-ylmethyl)azocane-2-carboxamide
CID 114240145
N-[[1-[2-(dimethylamino)ethyl]piperidin-4-yl]methyl]morpholine-3-carboxamide
CID 119862675
N-cycloheptylmorpholine-3-carboxamide;hydrochloride
CID 119674644
N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]morpholine-3-carboxamide;dihydrochloride
CID 119898858
N-(cyclobutylmethyl)azepane-2-carboxamide
CID 64564563
(3R)-N-ethylmorpholine-3-carboxamide
CID 96578732
N-[(2,2-dimethylcyclopropyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119785395
N-[(1,1-dioxothiolan-2-yl)methyl]morpholine-3-carboxamide
CID 81039320
N-[(2-propan-2-yloxan-3-yl)methyl]morpholine-3-carboxamide
CID 119819551

Frequently Asked Questions

What is the IUPAC name of N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride (CID 119741853) is N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride is Cl.O=C(NCC1CCCCCCC1)C1COCCN1.
What is the InChIKey of N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is DLJAEIOLWCAHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2.ClH/c17-14(13-11-18-9-8-15-13)16-10-12-6-4-2-1-3-5-7-12;/h12-13,15H,1-11H2,(H,16,17);1H.
What are the key properties of N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride?
N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 290.84 g/mol, XLogP of 1.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclooctylmethyl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119741853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).