N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride

C16H27ClN2O2 — CID 119665333

IUPACN-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)COc1ccc(CC)cc1.Cl
InChIInChI=1S/C16H26N2O2.ClH/c1-3-5-6-14(11-17)18-16(19)12-20-15-9-7-13(4-2)8-10-15;/h7-10,14H,3-6,11-12,17H2,1-2H3,(H,18,19);1H
InChIKeyFJOUIHOQXDIXKH-UHFFFAOYSA-N
MW314.86 g/mol
LogP2.68
Rot. Bonds9

About N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride

N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride (PubChem CID 119665333) has the molecular formula C16H27ClN2O2 and a molecular weight of 314.86 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride
PubChem CID119665333
Molecular FormulaC16H27ClN2O2
Molecular Weight314.86 g/mol
Exact Mass314.18
IUPAC NameN-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)COc1ccc(CC)cc1.Cl
InChIInChI=1S/C16H26N2O2.ClH/c1-3-5-6-14(11-17)18-16(19)12-20-15-9-7-13(4-2)8-10-15;/h7-10,14H,3-6,11-12,17H2,1-2H3,(H,18,19);1H
InChIKeyFJOUIHOQXDIXKH-UHFFFAOYSA-N
XLogP2.68
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.86
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminohexan-2-yl)-2-(4-propan-2-ylphenoxy)acetamide;hydrochloride
CID 119667507
N-(1-aminohexan-2-yl)-2-(3-propan-2-ylphenoxy)acetamide
CID 119668575
2-(4-ethylphenoxy)-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 94124569
N-(1-aminohexan-2-yl)-2-(2,4-dichlorophenoxy)acetamide;hydrochloride
CID 119664799
N-(1-aminohexan-2-yl)-2-naphthalen-1-yloxyacetamide;hydrochloride
CID 119666910
N-(1-aminohexan-2-yl)-2-(2-chloro-4-fluorophenoxy)acetamide;hydrochloride
CID 119664901
N-(1-aminohexan-2-yl)-2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 119667044
N-(1-aminohexan-2-yl)-2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]acetamide;hydrochloride
CID 119664891
N-(1-aminohexan-2-yl)-3-(4-fluorophenoxy)propanamide
CID 119665882
N-(1-aminohexan-2-yl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 119664820
N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride
CID 119664823
N-(1-aminohexan-2-yl)-2-(3-fluoro-4-methoxyphenyl)acetamide;hydrochloride
CID 119664953

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride (CID 119665333) is N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride is CCCCC(CN)NC(=O)COc1ccc(CC)cc1.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride?
The InChIKey is FJOUIHOQXDIXKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2.ClH/c1-3-5-6-14(11-17)18-16(19)12-20-15-9-7-13(4-2)8-10-15;/h7-10,14H,3-6,11-12,17H2,1-2H3,(H,18,19);1H.
What are the key properties of N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride?
N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride has a molecular weight of 314.86 g/mol, XLogP of 2.68, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride is sourced from PubChem (CID 119665333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).