N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride

C15H25ClN2O2 — CID 119664823

IUPACN-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)Cc1cccc(OC)c1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-3-4-7-13(11-16)17-15(18)10-12-6-5-8-14(9-12)19-2;/h5-6,8-9,13H,3-4,7,10-11,16H2,1-2H3,(H,17,18);1H
InChIKeyVBVGGUKRYISWNF-UHFFFAOYSA-N
MW300.83 g/mol
LogP2.29
Rot. Bonds8

About N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride

N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride (PubChem CID 119664823) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride
PubChem CID119664823
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC NameN-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride
SMILESCCCCC(CN)NC(=O)Cc1cccc(OC)c1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-3-4-7-13(11-16)17-15(18)10-12-6-5-8-14(9-12)19-2;/h5-6,8-9,13H,3-4,7,10-11,16H2,1-2H3,(H,17,18);1H
InChIKeyVBVGGUKRYISWNF-UHFFFAOYSA-N
XLogP2.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride?
The IUPAC name of N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride (CID 119664823) is N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride is CCCCC(CN)NC(=O)Cc1cccc(OC)c1.Cl.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride?
The InChIKey is VBVGGUKRYISWNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-3-4-7-13(11-16)17-15(18)10-12-6-5-8-14(9-12)19-2;/h5-6,8-9,13H,3-4,7,10-11,16H2,1-2H3,(H,17,18);1H.
What are the key properties of N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride?
N-(1-aminohexan-2-yl)-2-(3-methoxyphenyl)acetamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 2.29, 8 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-(3-methoxyphenyl)acetamide;hydrochloride is sourced from PubChem (CID 119664823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).