N-ethyloxan-3-amine;hydrochloride

C7H16ClNO — CID 122156621

IUPACN-ethyloxan-3-amine;hydrochloride
SMILESCCNC1CCCOC1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-2-8-7-4-3-5-9-6-7;/h7-8H,2-6H2,1H3;1H
InChIKeyUISRKDMJBWCYNO-UHFFFAOYSA-N
MW165.66 g/mol
LogP1.20
Rot. Bonds2

About N-ethyloxan-3-amine;hydrochloride

N-ethyloxan-3-amine;hydrochloride (PubChem CID 122156621) has the molecular formula C7H16ClNO and a molecular weight of 165.66 g/mol. Its IUPAC name is N-ethyloxan-3-amine;hydrochloride.

Molecular Properties

Compound NameN-ethyloxan-3-amine;hydrochloride
PubChem CID122156621
Molecular FormulaC7H16ClNO
Molecular Weight165.66 g/mol
Exact Mass165.09
IUPAC NameN-ethyloxan-3-amine;hydrochloride
SMILESCCNC1CCCOC1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-2-8-7-4-3-5-9-6-7;/h7-8H,2-6H2,1H3;1H
InChIKeyUISRKDMJBWCYNO-UHFFFAOYSA-N
XLogP1.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.66
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-Methyloxan-3-amine
CID 14145422
N-(2,2,2-trifluoroethyl)oxan-3-amine
CID 63363393
3-Ethylmorpholine--hydrogen chloride (1/1)
CID 22342764
3-(2-Methylpropyl)morpholine--hydrogen chloride (1/1)
CID 22342824
2-(Methoxymethyl)piperidine hydrochloride
CID 45926159
N-Methyloxan-3-amine--hydrogen chloride (1/1)
CID 53408654
Methyl(2-(morpholin-3-yl)ethyl)amine
CID 53849357
(3S)-3-Ethylmorpholine hydrochloride
CID 67094181
rac-(2R,3R)-3-methoxy-2-methylpiperidine hydrochloride
CID 138040349
3-Morpholinpropylamine
CID 14976719
(3S)-N-cyclohexyloxan-3-amine
CID 95380348
N-ethyloxan-3-amine
CID 63360368

Frequently Asked Questions

What is the IUPAC name of N-ethyloxan-3-amine;hydrochloride?
The IUPAC name of N-ethyloxan-3-amine;hydrochloride (CID 122156621) is N-ethyloxan-3-amine;hydrochloride.
What is the SMILES notation for N-ethyloxan-3-amine;hydrochloride?
The canonical SMILES for N-ethyloxan-3-amine;hydrochloride is CCNC1CCCOC1.Cl.
What is the InChIKey of N-ethyloxan-3-amine;hydrochloride?
The InChIKey is UISRKDMJBWCYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.ClH/c1-2-8-7-4-3-5-9-6-7;/h7-8H,2-6H2,1H3;1H.
What are the key properties of N-ethyloxan-3-amine;hydrochloride?
N-ethyloxan-3-amine;hydrochloride has a molecular weight of 165.66 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyloxan-3-amine;hydrochloride is sourced from PubChem (CID 122156621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).