4-ethyloxan-4-amine;hydrochloride

C7H16ClNO — CID 71757570

IUPAC4-ethyloxan-4-amine;hydrochloride
SMILESCCC1(N)CCOCC1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-2-7(8)3-5-9-6-4-7;/h2-6,8H2,1H3;1H
InChIKeyXAYXHPWEBURGOE-UHFFFAOYSA-N
MW165.66 g/mol
LogP1.33
Rot. Bonds1

About 4-ethyloxan-4-amine;hydrochloride

4-ethyloxan-4-amine;hydrochloride (PubChem CID 71757570) has the molecular formula C7H16ClNO and a molecular weight of 165.66 g/mol. Its IUPAC name is 4-ethyloxan-4-amine;hydrochloride.

Molecular Properties

Compound Name4-ethyloxan-4-amine;hydrochloride
PubChem CID71757570
Molecular FormulaC7H16ClNO
Molecular Weight165.66 g/mol
Exact Mass165.09
IUPAC Name4-ethyloxan-4-amine;hydrochloride
SMILESCCC1(N)CCOCC1.Cl
InChIInChI=1S/C7H15NO.ClH/c1-2-7(8)3-5-9-6-4-7;/h2-6,8H2,1H3;1H
InChIKeyXAYXHPWEBURGOE-UHFFFAOYSA-N
XLogP1.33
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.66
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyloxan-4-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Methyloxan-4-amine
CID 18437373
4-Methyloxan-4-amine hydrochloride
CID 18437372
4-Ethyloxan-4-amine
CID 63220680
2,4-Dimethyloxan-4-amine hydrochloride
CID 126836444
4-(1,1-Difluoroethyl)oxan-4-amine hydrochloride
CID 132372701
N,4-dimethyloxan-4-amine hydrochloride
CID 145867425
4-Propyloxan-4-amine hydrochloride
CID 170911901
1-Methoxy-3-methylpentan-3-amine hydrochloride
CID 177801168
3-Ethyl-1-methoxypentan-3-amine hydrochloride
CID 177801534
4-(Fluoromethyl)tetrahydro-2H-pyran-4-amine
CID 84762372
4-(2-Fluoropropan-2-yl)oxan-4-amine
CID 84764413
4-(2-Fluoroethyl)oxan-4-amine
CID 130515373

Frequently Asked Questions

What is the IUPAC name of 4-ethyloxan-4-amine;hydrochloride?
The IUPAC name of 4-ethyloxan-4-amine;hydrochloride (CID 71757570) is 4-ethyloxan-4-amine;hydrochloride.
What is the SMILES notation for 4-ethyloxan-4-amine;hydrochloride?
The canonical SMILES for 4-ethyloxan-4-amine;hydrochloride is CCC1(N)CCOCC1.Cl.
What is the InChIKey of 4-ethyloxan-4-amine;hydrochloride?
The InChIKey is XAYXHPWEBURGOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.ClH/c1-2-7(8)3-5-9-6-4-7;/h2-6,8H2,1H3;1H.
What are the key properties of 4-ethyloxan-4-amine;hydrochloride?
4-ethyloxan-4-amine;hydrochloride has a molecular weight of 165.66 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyloxan-4-amine;hydrochloride is sourced from PubChem (CID 71757570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).