2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride

C14H27ClN2O3 — CID 120789971

IUPAC2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride
SMILESCCC1CN(C(=O)C(N)C2CCOCC2)CC(C)O1.Cl
InChIInChI=1S/C14H26N2O3.ClH/c1-3-12-9-16(8-10(2)19-12)14(17)13(15)11-4-6-18-7-5-11;/h10-13H,3-9,15H2,1-2H3;1H
InChIKeyYLNAWZQVHKYPQT-UHFFFAOYSA-N
MW306.83 g/mol
LogP1.19
Rot. Bonds3

About 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride

2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride (PubChem CID 120789971) has the molecular formula C14H27ClN2O3 and a molecular weight of 306.83 g/mol. Its IUPAC name is 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride.

Molecular Properties

Compound Name2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride
PubChem CID120789971
Molecular FormulaC14H27ClN2O3
Molecular Weight306.83 g/mol
Exact Mass306.17
IUPAC Name2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride
SMILESCCC1CN(C(=O)C(N)C2CCOCC2)CC(C)O1.Cl
InChIInChI=1S/C14H26N2O3.ClH/c1-3-12-9-16(8-10(2)19-12)14(17)13(15)11-4-6-18-7-5-11;/h10-13H,3-9,15H2,1-2H3;1H
InChIKeyYLNAWZQVHKYPQT-UHFFFAOYSA-N
XLogP1.19
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.83
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)propan-1-one;hydrochloride
CID 119304817
3-amino-1-(2-ethyl-6-methylmorpholin-4-yl)butan-1-one;hydrochloride
CID 119751436
2-amino-1-(3,3-diethylpyrrolidin-1-yl)-2-(oxan-4-yl)ethanone;hydrochloride
CID 120792953
(2R)-2-amino-1-[(2R,6S)-2-ethyl-6-methylmorpholin-4-yl]-3-phenylpropan-1-one
CID 125133936
(1-aminocyclopropyl)-(2-ethyl-6-methylmorpholin-4-yl)methanone;hydrochloride
CID 119751390
2-(cyclopropylmethylamino)-1-(2-ethyl-6-methylmorpholin-4-yl)ethanone;hydrochloride
CID 119751420
3-amino-1-(2-ethyl-6-methylmorpholin-4-yl)propan-1-one
CID 119304810
N-[1-[2-amino-2-(oxan-4-yl)acetyl]piperidin-3-yl]propanamide;hydrochloride
CID 120790917
2-amino-1-[3-(2-methylpropoxy)pyrrolidin-1-yl]-2-(oxan-4-yl)ethanone;hydrochloride
CID 120796599
2-amino-1-[3-(methoxymethyl)piperidin-1-yl]-2-(oxan-4-yl)ethanone;hydrochloride
CID 120792917
2-amino-1-(2,6-dimethylmorpholin-4-yl)pentan-1-one;hydrochloride
CID 119261693
2-amino-1-[(3S)-3-methoxypyrrolidin-1-yl]-2-(oxan-4-yl)ethanone
CID 120793854

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride?
The IUPAC name of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride (CID 120789971) is 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride.
What is the SMILES notation for 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride?
The canonical SMILES for 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride is CCC1CN(C(=O)C(N)C2CCOCC2)CC(C)O1.Cl.
What is the InChIKey of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride?
The InChIKey is YLNAWZQVHKYPQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3.ClH/c1-3-12-9-16(8-10(2)19-12)14(17)13(15)11-4-6-18-7-5-11;/h10-13H,3-9,15H2,1-2H3;1H.
What are the key properties of 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride?
2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride has a molecular weight of 306.83 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-ethyl-6-methylmorpholin-4-yl)-2-(oxan-4-yl)ethanone;hydrochloride is sourced from PubChem (CID 120789971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).