N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride

C12H23ClN2O3 — CID 119813302

IUPACN-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride
SMILESCN(CCOCC1CC1)C(=O)C1CNCCO1.Cl
InChIInChI=1S/C12H22N2O3.ClH/c1-14(5-7-16-9-10-2-3-10)12(15)11-8-13-4-6-17-11;/h10-11,13H,2-9H2,1H3;1H
InChIKeyOJVIBFJGNHMJLQ-UHFFFAOYSA-N
MW278.78 g/mol
LogP0.28
Rot. Bonds6

About N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride

N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride (PubChem CID 119813302) has the molecular formula C12H23ClN2O3 and a molecular weight of 278.78 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride
PubChem CID119813302
Molecular FormulaC12H23ClN2O3
Molecular Weight278.78 g/mol
Exact Mass278.14
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride
SMILESCN(CCOCC1CC1)C(=O)C1CNCCO1.Cl
InChIInChI=1S/C12H22N2O3.ClH/c1-14(5-7-16-9-10-2-3-10)12(15)11-8-13-4-6-17-11;/h10-11,13H,2-9H2,1H3;1H
InChIKeyOJVIBFJGNHMJLQ-UHFFFAOYSA-N
XLogP0.28
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidine-3-carboxamide;hydrochloride
CID 119340577
N-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119340564
N-[2-(4-fluorophenoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride
CID 119695324
N-[2-(cyclopropylmethoxy)ethyl]morpholine-2-carboxamide
CID 103809948
N,N-dimethylmorpholine-2-carboxamide;hydrochloride
CID 71298970
N-(2,2-difluoroethyl)-N-methylmorpholine-2-carboxamide;hydrochloride
CID 119752897
N-methyl-N-(oxolan-2-ylmethyl)morpholine-2-carboxamide;hydrochloride
CID 119708798
N-(2-hydroxypropyl)-N-methylmorpholine-2-carboxamide
CID 62333960
(2R)-N-methyl-N-(3-pyrrolidin-1-ylpropyl)morpholine-2-carboxamide
CID 125443617
(2S)-N-methyl-N-(3-pyrrolidin-1-ylpropyl)morpholine-2-carboxamide
CID 125443618
N,N-dimethylmorpholine-2-carboxamide;ethane
CID 144883589
2-[2-[methyl(morpholine-2-carbonyl)amino]ethyl]benzoic acid
CID 104548311

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride (CID 119813302) is N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride is CN(CCOCC1CC1)C(=O)C1CNCCO1.Cl.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride?
The InChIKey is OJVIBFJGNHMJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O3.ClH/c1-14(5-7-16-9-10-2-3-10)12(15)11-8-13-4-6-17-11;/h10-11,13H,2-9H2,1H3;1H.
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride?
N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride has a molecular weight of 278.78 g/mol, XLogP of 0.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119813302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).