N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride

C15H23ClF2N2O2 — CID 119666599

IUPACN-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)Cc1ccccc1OC(F)F.Cl
InChIInChI=1S/C15H22F2N2O2.ClH/c1-2-3-7-12(10-18)19-14(20)9-11-6-4-5-8-13(11)21-15(16)17;/h4-6,8,12,15H,2-3,7,9-10,18H2,1H3,(H,19,20);1H
InChIKeyOZZDCUWFFDATNI-UHFFFAOYSA-N
MW336.81 g/mol
LogP2.89
Rot. Bonds9

About N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride

N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride (PubChem CID 119666599) has the molecular formula C15H23ClF2N2O2 and a molecular weight of 336.81 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride
PubChem CID119666599
Molecular FormulaC15H23ClF2N2O2
Molecular Weight336.81 g/mol
Exact Mass336.14
IUPAC NameN-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)Cc1ccccc1OC(F)F.Cl
InChIInChI=1S/C15H22F2N2O2.ClH/c1-2-3-7-12(10-18)19-14(20)9-11-6-4-5-8-13(11)21-15(16)17;/h4-6,8,12,15H,2-3,7,9-10,18H2,1H3,(H,19,20);1H
InChIKeyOZZDCUWFFDATNI-UHFFFAOYSA-N
XLogP2.89
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.81
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminohexan-2-yl)-2-(2-chlorophenyl)acetamide;hydrochloride
CID 119667896
N-(1-aminohexan-2-yl)-2-(2-methylphenyl)acetamide
CID 80697183
N-[(2S)-1-aminopropan-2-yl]-2-[2-(difluoromethoxy)phenyl]acetamide
CID 120505995
N-(1-aminohexan-2-yl)-2-(difluoromethoxy)-4-fluorobenzamide;hydrochloride
CID 119665751
N-(1-aminohexan-2-yl)-2-(2-fluorophenoxy)butanamide;hydrochloride
CID 119668887
2-[[2-[2-(difluoromethoxy)phenyl]acetyl]amino]propanoic acid
CID 119225812
N-(1-aminohexan-2-yl)-2-naphthalen-1-yloxyacetamide;hydrochloride
CID 119666910
N-(1-aminohexan-2-yl)-2-[2-(trifluoromethyl)phenoxy]propanamide;hydrochloride
CID 119667198
N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride
CID 119664823
N-(1-aminohexan-2-yl)-4-(2-chlorophenoxy)butanamide;hydrochloride
CID 119668746
N-(1-aminohexan-2-yl)-2-(3-fluoro-4-methoxyphenyl)acetamide;hydrochloride
CID 119664953
N-(1-aminohexan-2-yl)-3-(difluoromethoxy)-4-methoxybenzamide
CID 119666149

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride (CID 119666599) is N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride is CCCCC(CN)NC(=O)Cc1ccccc1OC(F)F.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride?
The InChIKey is OZZDCUWFFDATNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N2O2.ClH/c1-2-3-7-12(10-18)19-14(20)9-11-6-4-5-8-13(11)21-15(16)17;/h4-6,8,12,15H,2-3,7,9-10,18H2,1H3,(H,19,20);1H.
What are the key properties of N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride?
N-(1-aminohexan-2-yl)-2-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride has a molecular weight of 336.81 g/mol, XLogP of 2.89, 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-[2-(difluoromethoxy)phenyl]acetamide;hydrochloride is sourced from PubChem (CID 119666599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).